data_2jtn_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 2jtn _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 ' 7' ' ' VAL . . . . . 0.427 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 13.5 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.852 0.358 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.425 ' HE3' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -139.74 -179.96 6.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.682 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.5 p -155.06 137.0 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.115 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG23 ' CE1' ' A' ' 163' ' ' PHE . 48.1 t -57.88 146.14 8.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.565 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.62 -151.11 6.44 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.782 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -71.8 122.57 87.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.446 0.165 . . . . 0.0 110.954 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -64.44 142.92 80.62 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.328 2.019 . . . . 0.0 112.149 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.04 158.43 14.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.435 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.8 OUTLIER -129.2 173.31 10.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.155 0.502 . . . . 0.0 111.267 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -37.84 81.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.932 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 57.01 79.62 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.552 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -145.55 -55.35 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 64.19 29.48 13.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.729 0.299 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 58.93 -168.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.973 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -148.99 125.3 2.0 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -59.9 -31.53 69.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.51 -30.23 70.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.46 -74.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 5.7 tp10 -78.2 151.35 33.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.977 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -76.08 101.96 5.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.875 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.92 165.13 25.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.86 137.61 24.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -104.34 106.89 17.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 101.77 11.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.469 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.4 157.31 44.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.001 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.08 116.88 18.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.6 163.71 23.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.5 t -107.4 31.57 5.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -104.1 37.63 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -98.69 31.49 2.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.911 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -167.31 33.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.844 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.145 179.932 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.684 0.278 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.74 167.15 23.8 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.468 2.112 . . . . 0.0 112.211 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 57.9 30.01 18.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.762 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.424 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -104.5 135.38 19.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.046 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.69 125.89 18.4 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.412 2.074 . . . . 0.0 112.069 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.48 148.76 21.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.109 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.428 ' SG ' ' ND1' ' A' ' 84' ' ' HIS . 7.3 t -58.36 138.11 56.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.735 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -61.6 114.85 3.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.269 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.92 28.29 42.5 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.069 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.12 -178.92 5.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.883 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -106.73 -28.93 9.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.76 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -166.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.821 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.424 ' CD2' HG21 ' A' ' 60' ' ' ILE . 5.1 p80 -107.53 161.51 14.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.02 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.435 HD12 ' CE1' ' A' ' 84' ' ' HIS . 6.9 mm -74.83 153.66 6.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.053 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 30.84 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -107.2 -178.99 3.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -84.46 -74.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -75.74 125.59 29.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.6 mm -134.27 148.2 29.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.123 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mp -105.38 106.97 17.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.465 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -90.93 114.98 27.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.94 163.47 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.115 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.41 HD13 ' CZ2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER 55.45 35.59 25.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.07 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 62.36 40.75 10.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -176.99 166.5 2.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.013 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -88.88 117.97 28.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.458 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 65.1 m95 -111.77 126.0 54.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.844 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.435 ' CE1' HD12 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -51.57 175.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.171 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -80.03 -40.69 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.283 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -91.08 -16.48 27.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.128 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -96.4 26.1 4.58 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.7 tp -128.62 29.24 5.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.996 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.38 150.26 21.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 4.3 t -60.46 125.25 22.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.816 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.29 -22.51 61.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.289 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -99.69 -63.08 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.735 0.302 . . . . 0.0 111.206 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 32.0 m -66.76 -32.31 73.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.169 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 59.07 23.35 11.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.102 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.1 m -90.82 149.34 40.17 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.153 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.82 118.95 5.8 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.561 2.174 . . . . 0.0 112.248 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.9 mp -111.04 63.05 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.733 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.78 39.49 1.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.188 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -148.25 -49.18 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -136.52 174.2 10.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.8 t -156.98 156.15 32.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.925 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.504 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.7 OUTLIER -150.13 154.63 38.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 60.1 p -132.29 144.76 50.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.993 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.64 139.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.6 40.11 95.96 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.569 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 59.6 31.22 20.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -148.99 145.15 27.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.1 p -87.22 115.97 28.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.127 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.68 170.52 8.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.826 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.5 p -99.56 169.04 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.83 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 4.5 tttp -78.13 -29.79 49.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.267 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -53.42 -58.02 8.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.469 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.5 p30 -74.16 -20.94 60.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.314 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 13.5 t80 -63.65 -30.95 71.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.75 0.31 . . . . 0.0 110.926 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 5.1 m-85 -79.12 -39.21 34.21 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -85.07 -64.04 1.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.335 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -64.79 -48.62 73.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.64 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -102.01 36.89 1.98 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.332 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.94 -146.61 4.44 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.594 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.0 m -94.79 152.35 18.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 110.977 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.45 170.37 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.5 t -64.11 141.34 58.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.74 27.14 3.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.121 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.24 -58.08 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.9 p -108.27 5.4 25.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.414 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 59.38 29.47 19.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.14 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.85 151.95 25.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.742 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -81.13 107.79 2.75 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.698 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.435 ' CG2' HD11 ' A' ' 15' ' ' LEU . 12.1 mt -70.41 130.92 88.7 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 110.52 -0.178 . . . . 0.0 110.52 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.609 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.5 Cg_exo -47.52 175.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.361 2.041 . . . . 0.0 112.23 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.7 Cg_endo -77.2 -49.91 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.471 2.114 . . . . 0.0 113.799 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.06 21.7 7.41 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.609 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -57.0 -168.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.68 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.59 108.9 21.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.936 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.4 p -152.67 158.87 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.065 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.86 135.92 38.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.793 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.93 135.0 47.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.975 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.429 ' HB1' ' CD1' ' A' ' 143' ' ' TYR . . . -74.31 96.57 2.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.939 0.399 . . . . 0.0 110.618 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 55.75 -86.33 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.4 -48.19 4.88 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.873 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -83.95 162.58 20.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.715 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.3 150.9 7.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.429 ' CD1' ' HB1' ' A' ' 138' ' ' ALA . 23.0 m-85 -133.26 175.08 9.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.452 . . . . 0.0 111.37 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 161.84 22.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.046 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.08 -30.2 34.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.149 0.5 . . . . 0.0 109.678 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -91.2 -49.26 6.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.665 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 74.7 m -53.87 -31.26 49.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.9 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.432 ' CZ ' HD23 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.91 121.1 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.091 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.24 -177.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -100.92 150.14 23.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.73 -26.87 41.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.263 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -109.53 -55.9 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.338 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 m -65.86 -28.11 68.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.012 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 30.87 17.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.986 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -119.02 139.97 50.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.951 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -58.11 154.29 13.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.26 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.482 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.7 OUTLIER -116.57 107.32 14.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.538 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -90.17 172.28 8.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 7.9 m -43.01 132.29 4.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.734 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.35 -27.86 13.97 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.664 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.0 128.84 37.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.802 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -88.04 122.21 31.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.449 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 8.2 p90 -138.45 146.75 42.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.427 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 48.1 m-85 -101.58 151.47 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.2 tp -107.65 110.96 22.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.797 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.5 mtp -69.4 161.23 29.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -62.7 -28.57 70.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.074 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -97.76 29.11 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.019 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.14 83.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.978 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -154.92 131.66 10.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.4 mp -83.62 128.21 34.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.11 122.45 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.082 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 20.4 m -58.38 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -75.52 -57.05 4.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.84 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -33.6 70.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.108 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -72.98 -28.91 62.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -56.84 -66.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.946 0.403 . . . . 0.0 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.31 -49.73 75.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.942 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 67.5 m -59.43 -26.3 65.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.964 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -79.08 -51.98 8.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.252 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.74 -66.57 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.098 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.203 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.437 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.874 0.369 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.42 ' HE2' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -139.45 -173.64 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.595 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.3 p -151.82 147.69 15.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.424 HG23 ' CD1' ' A' ' 163' ' ' PHE . 43.9 t -66.95 146.23 13.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.628 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.32 -157.9 9.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.572 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 0.0 OUTLIER -76.31 151.29 83.35 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.665 0.269 . . . . 0.0 110.815 -179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 2.6 Cg_endo -83.0 143.47 11.54 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.874 2.383 . . . . 0.0 112.417 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.57 142.92 8.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.344 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mt -127.04 173.54 9.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 111.293 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -50.49 41.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.793 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.405 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 62.69 80.82 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.457 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -160.27 -48.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.368 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 59.56 46.33 12.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 110.923 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE1' ' CD1' ' A' ' 115' ' ' PHE . 14.0 p90 -59.17 -179.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.929 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -173.54 -132.41 1.53 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.567 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -55.21 -28.42 52.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.736 0.303 . . . . 0.0 111.16 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.35 -25.99 60.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.201 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.89 -70.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.073 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.429 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.3 tp10 -101.62 175.11 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 100.68 4.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tp -63.15 165.11 7.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.3 pt -62.9 148.49 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.5 m -107.74 106.78 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.82 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.19 101.82 9.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.435 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -146.86 154.02 40.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -78.63 157.05 28.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -110.6 102.31 10.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 41.3 p -60.18 86.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -150.32 -76.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 57.68 28.58 16.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.025 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -176.67 78.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.902 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 -179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.617 0.246 . . . . 0.0 110.88 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.43 163.96 36.34 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.49 2.127 . . . . 0.0 112.226 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 56.98 29.07 15.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.447 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -99.1 134.89 21.02 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.077 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -58.46 125.96 19.95 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.458 2.105 . . . . 0.0 112.097 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.19 140.12 29.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.057 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.482 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 14.3 p -58.36 164.22 2.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.93 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . . . -87.98 114.59 24.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.445 179.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 125.09 -66.46 0.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.56 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.482 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 14.2 p -109.83 155.34 21.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.858 0.361 . . . . 0.0 110.896 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -75.39 87.53 2.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.143 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.47 134.44 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.447 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 11.5 p80 -72.77 141.05 48.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.45 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.6 mm -67.52 153.65 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -172.55 35.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.864 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.82 145.83 38.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.179 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.0 110.84 18.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.853 0.359 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.0 mm -121.67 153.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.211 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.8 mp -109.61 106.75 16.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.305 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -91.03 116.36 28.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.964 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -157.13 165.63 35.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.163 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 mt 59.09 36.43 24.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.072 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 62.3 34.42 15.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.023 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -176.45 178.57 1.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.917 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.406 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 22.1 p-80 -94.41 126.85 39.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.422 ' CZ2' ' HB2' ' A' ' 64' ' ' ALA . 36.7 m95 -116.86 132.73 56.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.45 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.08 171.55 0.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.07 -40.21 28.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.089 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 pttp -90.95 -28.18 18.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.127 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.413 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 57.7 m -67.6 -30.62 70.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tp -81.12 94.12 6.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -155.35 154.53 32.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.933 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 147.03 38.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.7 t -72.78 -31.27 64.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.916 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -97.28 -59.97 1.68 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.977 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 45.7 m -60.02 -34.47 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 57.37 22.46 7.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.056 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -84.63 156.65 61.74 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.048 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.9 118.9 5.94 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.522 2.148 . . . . 0.0 112.246 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.4 mp -103.24 71.03 1.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -106.07 30.91 5.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -148.55 -49.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.412 ' CD ' ' N ' ' A' ' 100' ' ' ARG . 0.0 OUTLIER -142.99 128.99 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.5 t -123.83 171.09 9.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.462 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 1.6 m-85 -156.32 151.5 26.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -151.65 140.05 20.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -150.01 123.97 9.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.23 -88.64 1.59 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.506 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.02 35.86 0.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.421 ' HB2' ' CE1' ' A' ' 109' ' ' TYR . 48.9 m -150.73 -175.02 4.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.7 p -136.97 116.0 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.082 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 107' ' ' SER . 1.3 m-85 -116.69 173.24 6.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.9 p -89.13 178.31 6.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.42 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 12.3 ttmt -73.65 -48.97 28.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.91 -30.55 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.218 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -84.04 -21.64 31.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.319 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 12.9 t80 -69.52 -41.17 76.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 6.6 m-85 -66.78 -36.8 83.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.921 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.36 -44.4 13.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.25 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -78.94 -50.92 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.244 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -108.67 37.02 2.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.59 165.25 33.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.444 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -57.85 151.08 18.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.757 0.313 . . . . 0.0 110.842 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -163.3 159.43 22.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.167 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.3 t -74.2 135.76 42.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.787 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.66 34.21 1.9 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.12 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.096 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.5 p -109.9 12.54 23.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.411 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.7 mp0 55.5 30.84 15.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.754 0.311 . . . . 0.0 111.04 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -103.49 130.49 50.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.96 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.98 131.19 51.93 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.444 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.442 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 51.9 mt -79.25 140.06 56.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.922 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.562 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 92.7 Cg_exo -44.83 171.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.833 2.355 . . . . 0.0 112.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -77.37 -55.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.588 2.192 . . . . 0.0 114.807 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.405 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 1.6 m -126.55 21.46 7.13 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.562 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 82.9 mm-40 -61.42 -176.04 0.07 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.65 116.49 49.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.973 0.416 . . . . 0.0 111.167 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.8 p -157.06 162.96 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.523 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.473 ' NE ' ' CZ ' ' A' ' 148' ' ' PHE . 0.0 OUTLIER -96.22 142.17 28.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.016 0.436 . . . . 0.0 110.857 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . 0.416 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.6 OUTLIER -116.05 123.64 48.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.836 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -57.43 96.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.077 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.98 -87.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.223 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 138' ' ' ALA . 6.5 t0 -96.64 -47.13 6.03 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.988 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.88 157.31 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.083 0.468 . . . . 0.0 111.746 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.416 ' HA ' ' CB ' ' A' ' 137' ' ' ARG . 7.6 p -107.68 149.51 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.621 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -131.92 163.24 28.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.008 0.432 . . . . 0.0 111.403 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.59 165.38 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.964 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.03 -32.76 33.99 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -91.34 -49.26 6.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.903 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 80.8 m -50.44 -38.93 46.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.321 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.473 ' CZ ' ' NE ' ' A' ' 136' ' ' ARG . 2.5 t80 -56.91 118.38 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.233 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.09 179.24 2.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.048 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -85.33 150.09 25.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.971 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 8.2 m -72.17 -34.64 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.95 -51.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 14.0 m -66.02 -28.05 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.982 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm 57.79 40.71 25.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.132 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -128.96 143.16 50.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.972 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -61.35 172.36 1.15 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.954 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.436 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.8 mm? -127.45 164.62 21.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 158.91 43.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.4 t -43.01 129.46 4.44 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.619 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.75 -27.95 16.85 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.553 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -70.27 129.13 38.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.772 0.32 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -89.31 114.92 26.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.972 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.456 ' CE2' HD23 ' A' ' 171' ' ' LEU . 7.2 p90 -129.64 152.05 49.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 23.0 m-85 -101.48 139.31 37.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.739 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.94 127.09 46.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.707 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.4 mmt -90.66 161.92 15.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.039 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -23.6 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -96.05 27.45 3.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.093 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.06 30.09 15.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.099 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 154.52 19.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.862 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.456 HD23 ' CE2' ' A' ' 163' ' ' PHE . 0.4 OUTLIER -109.25 121.73 45.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.024 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.08 121.67 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.002 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 21.7 p -76.07 -169.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -43.39 54.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.283 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.05 -52.25 61.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.6 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -84.98 4.06 35.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.64 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.0 t80 -67.53 -66.11 0.6 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.881 0.372 . . . . 0.0 110.83 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.13 -23.53 65.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 75.2 m -84.64 -32.75 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.046 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -89.91 -29.66 18.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.284 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 61.79 175.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.965 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.789 0.328 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.442 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.11 178.73 6.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.663 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.4 p -154.96 135.39 4.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.248 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG21 ' CE1' ' A' ' 163' ' ' PHE . 61.4 t -53.54 146.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.592 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -139.35 -148.63 5.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.657 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -72.98 115.28 38.74 Favored Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 122.906 -0.173 . . . . 0.0 110.73 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -62.3 135.41 53.91 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.251 1.967 . . . . 0.0 112.213 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.23 167.9 27.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.42 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 1.4 mt -143.99 173.91 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.226 0.536 . . . . 0.0 111.746 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -35.99 71.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.501 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.408 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 56.99 94.78 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.589 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.43 103.33 0.31 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.298 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 16.5 mt-10 -50.91 -71.71 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 111.069 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -176.94 -66.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.91 120.97 1.41 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.489 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.95 -44.22 14.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -29.69 68.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.79 -31.34 68.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.962 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 6.6 tp10 -109.23 160.68 15.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.933 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.29 101.92 5.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.901 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.89 164.95 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.85 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.8 pt -62.95 147.88 11.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.22 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -114.88 106.91 14.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.757 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.77 101.83 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.626 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.65 146.86 31.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.947 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -75.4 147.75 39.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -104.87 160.14 15.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.6 t -98.7 32.56 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -105.63 78.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -94.23 -33.32 13.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.912 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -131.86 82.23 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.079 -179.971 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.665 0.269 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.12 164.57 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.542 2.161 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 59.5 30.81 20.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.925 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.433 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.6 tp -103.81 134.75 19.56 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.034 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -58.72 125.93 19.73 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.415 2.077 . . . . 0.0 112.056 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.33 138.51 31.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.13 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.457 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 13.8 p -57.98 164.27 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -87.86 114.66 24.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.501 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.59 -71.1 0.45 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.527 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.457 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.6 p -103.59 153.07 21.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.826 0.346 . . . . 0.0 110.965 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -74.03 87.04 1.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -179.05 137.74 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.433 ' CG ' HG12 ' A' ' 60' ' ' ILE . 12.3 p80 -76.53 145.8 38.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.446 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -73.53 153.76 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.94 35.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.961 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -110.59 159.61 17.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -60.11 -75.25 0.06 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -74.86 112.12 10.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.3 mm -120.93 152.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.226 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.9 mp -111.79 106.78 15.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -90.81 128.01 36.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -161.48 158.95 27.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.261 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.404 ' CD1' ' NE1' ' A' ' 83' ' ' TRP . 0.6 OUTLIER 59.57 38.45 22.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.09 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 61.43 29.32 18.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -173.9 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.866 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.409 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 23.4 p-80 -105.34 124.31 49.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.453 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 49.3 m95 -112.37 130.77 55.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.714 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.446 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.14 171.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.1 -39.98 28.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.003 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -91.03 -29.79 17.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 74.6 m -67.13 -30.73 70.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.957 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tp -69.5 90.61 0.55 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -148.42 148.27 30.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.846 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.8 t -58.13 147.04 31.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 t -74.75 -29.1 61.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.252 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.847 0.356 . . . . 0.0 111.16 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 15.9 m -61.7 -32.57 72.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 54.15 24.73 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.129 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -83.9 146.7 49.67 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.138 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.63 118.99 5.69 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.533 2.155 . . . . 0.0 112.268 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -114.32 108.66 17.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.88 30.99 2.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.174 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -139.78 -47.08 0.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.43 174.21 10.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -157.0 127.98 6.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.948 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.418 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 50.2 t80 -129.93 120.64 25.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 93.2 p -138.0 156.1 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.5 mtt85 -154.03 124.43 7.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.931 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.18 -54.15 4.22 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.532 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -176.33 -42.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.331 . . . . 0.0 110.88 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -78.73 151.29 32.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.832 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 13.0 p -114.12 122.75 68.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.049 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -145.54 133.08 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 17.9 p -55.59 148.38 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.427 ' HB3' ' CE1' ' A' ' 115' ' ' PHE . 1.8 mtmp? -64.09 -19.98 65.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.421 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 t0 -46.62 -58.07 4.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.818 0.342 . . . . 0.0 111.323 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -77.68 -20.62 53.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.075 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.505 ' CZ ' ' CD2' ' A' ' 118' ' ' PHE . 11.1 t80 -58.16 -27.89 64.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.899 0.381 . . . . 0.0 110.695 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.427 ' CE1' ' HB3' ' A' ' 111' ' ' LYS . 1.9 m-85 -73.04 -28.77 62.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -82.31 -31.8 29.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.503 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.437 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 9.1 ptp180 -88.57 -37.25 15.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.443 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.505 ' CD2' ' CZ ' ' A' ' 114' ' ' PHE . 93.9 m-85 -103.36 -43.11 5.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.888 0.375 . . . . 0.0 111.151 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -70.31 170.83 44.37 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.468 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 71.5 m -58.65 152.36 18.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 110.805 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -138.65 172.33 13.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.037 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.1 t -85.27 129.61 34.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.958 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.51 30.62 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.034 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.454 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.08 -56.17 1.56 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.7 p -107.83 -20.12 13.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.162 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 68.63 70.74 0.29 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.84 0.353 . . . . 0.0 110.868 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 tp -130.28 -165.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -105.48 99.35 1.56 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.678 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.427 ' CG2' HD12 ' A' ' 15' ' ' LEU . 16.1 mt -75.73 125.59 88.23 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.47 0.176 . . . . 0.0 110.719 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.583 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.8 Cg_exo -51.62 -180.0 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.141 1.894 . . . . 0.0 111.96 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 74.4 Cg_endo -77.32 -49.39 0.1 Allowed 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.398 2.065 . . . . 0.0 113.818 -179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.408 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.8 21.72 7.58 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.583 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.0 OUTLIER -55.71 146.47 21.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.277 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.87 108.92 19.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.998 0.427 . . . . 0.0 111.028 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.0 p -153.25 159.33 3.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.105 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 137.64 35.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.666 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.01 150.86 24.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.425 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . . . -92.43 96.49 10.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.178 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.413 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -93.57 -46.88 7.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.843 -177.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -87.27 166.92 14.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.679 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 7.3 p -119.82 127.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.785 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.454 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 4.3 m-85 -110.06 134.78 51.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.989 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.421 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 71.1 m80 -59.52 138.95 57.53 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.853 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.43 -19.64 57.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -85.06 -37.88 19.8 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.9 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.7 p -98.16 12.88 33.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.451 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 3.4 t80 -86.14 121.92 29.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.735 0.302 . . . . 0.0 110.832 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.98 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.122 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 150.08 24.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 4.7 m -66.08 -30.32 49.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.114 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 27.9 t -111.81 -52.2 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.108 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 15.3 m -65.99 -28.05 68.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt 57.66 32.58 22.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.998 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -111.93 133.96 53.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -62.3 157.91 18.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.124 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.477 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.3 OUTLIER -126.74 125.41 41.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -104.05 177.73 4.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.409 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.1 m -45.61 129.31 8.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.668 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.88 -27.09 15.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.792 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.58 128.97 39.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.76 0.314 . . . . 0.0 110.793 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -87.91 129.61 35.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.039 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.442 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 10.9 p90 -150.75 154.13 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.006 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.46 171.02 7.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.47 111.03 12.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.827 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.91 -178.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.947 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -27.52 33.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -97.5 29.68 3.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.076 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.48 83.63 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -150.37 147.12 27.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.451 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.99 121.03 32.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 9.4 p -145.09 126.39 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.949 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.1 p -78.07 -175.39 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.818 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -78.57 -26.94 45.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.13 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.94 78.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.35 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -103.92 -4.51 23.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.673 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -56.99 -66.19 0.49 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.75 -27.2 64.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.873 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 -39.75 61.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.12 4.05 51.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.599 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.04 -177.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.957 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.406 ' CG2' ' CE1' ' A' ' 164' ' ' TYR . 11.0 p . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.848 0.356 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -112.45 -176.94 3.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.643 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -155.14 136.53 5.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.345 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.3 t -61.38 145.54 12.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.649 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.14 -171.07 13.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.429 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.6 mt-10 -61.03 149.19 82.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.0 Cg_endo -78.27 138.79 16.21 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.593 2.195 . . . . 0.0 112.373 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -164.11 142.91 7.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.265 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.414 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 1.0 OUTLIER -119.82 173.54 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.129 0.49 . . . . 0.0 111.455 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -36.13 82.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 57.53 98.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.544 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.33 -76.95 0.12 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.568 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 61.05 77.37 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.785 0.326 . . . . 0.0 110.837 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.513 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 11.1 p90 -59.43 -39.51 83.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 65.17 179.77 8.05 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.638 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -57.63 -21.98 42.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.692 0.282 . . . . 0.0 111.195 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -54.45 -27.62 38.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -77.91 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.943 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 53.6 tp10 -92.75 156.28 17.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.991 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -76.02 100.05 4.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.22 160.15 22.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.6 pt -63.0 141.29 18.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.105 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.9 m -115.96 106.97 14.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.752 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -78.47 101.91 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.794 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -141.94 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.965 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -69.22 156.96 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -100.78 -170.07 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -98.83 -33.29 10.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.64 173.13 1.8 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.411 ' CE2' ' HD3' ' A' ' 73' ' ' ARG . 0.7 OUTLIER -176.24 -43.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -128.49 31.55 4.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.911 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.103 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.653 0.263 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.73 161.86 41.92 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.528 2.152 . . . . 0.0 112.191 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 59.73 31.18 20.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.452 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -104.72 134.73 19.51 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.046 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.8 125.94 18.46 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.405 2.07 . . . . 0.0 112.102 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.71 140.44 32.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.532 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 13.0 p -57.59 164.2 2.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.0 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.423 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -85.12 114.67 22.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.569 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.13 -72.82 0.38 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.558 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.532 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 14.3 p -100.72 154.04 18.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.785 0.326 . . . . 0.0 110.962 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -76.03 86.22 2.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.158 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.04 127.63 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.452 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 10.1 p80 -63.97 161.84 15.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.933 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.406 HD11 ' CD2' ' A' ' 84' ' ' HIS . 8.8 mm -94.5 153.09 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.968 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.4 ' CD2' ' ND1' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -162.12 30.34 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.921 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -103.67 176.16 5.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.934 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.411 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -83.06 -78.32 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.708 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.26 97.37 0.93 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.755 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -104.9 141.34 20.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -89.81 106.98 18.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.621 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -90.9 115.53 28.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -157.02 158.93 37.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.261 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.33 36.77 23.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.077 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.18 30.22 17.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -168.22 178.77 4.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 27.3 p-80 -96.56 125.05 40.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.423 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 36.8 m95 -113.72 133.21 55.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.772 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.406 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.69 173.1 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -79.99 -40.65 27.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -90.97 -30.71 16.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -67.3 -31.03 71.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.983 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 22.8 tp -71.7 81.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -138.55 164.11 30.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.14 146.89 43.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.925 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.17 -27.41 68.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.059 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -111.73 -57.77 2.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.038 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -59.25 -45.17 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.068 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 61.09 23.25 13.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.1 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.0 m -86.57 157.77 55.05 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.14 118.96 5.93 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.482 2.121 . . . . 0.0 112.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.1 mp -110.05 35.95 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.54 -17.82 63.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.559 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -91.35 -55.34 3.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.755 0.312 . . . . 0.0 110.987 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -142.6 160.97 39.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.8 t -157.06 127.95 6.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -105.89 160.63 15.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -139.75 157.62 45.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.414 ' HG3' ' CE2' ' A' ' 109' ' ' TYR . 2.8 mmp_? -141.31 172.06 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.818 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.78 68.48 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.566 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -90.08 -71.1 0.63 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.784 0.326 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.06 -173.23 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.972 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.5 p -99.5 123.33 52.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.16 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.414 ' CE2' ' HG3' ' A' ' 104' ' ' ARG . 1.1 m-85 -121.49 161.57 22.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 15.1 p -82.92 168.38 17.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.713 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 1.0 OUTLIER -57.9 -35.99 71.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.022 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 4.4 t70 -76.33 -23.6 54.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.194 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.6 -21.06 49.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.407 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.513 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 11.6 t80 -67.64 -44.89 76.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.813 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.497 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 17.3 m-85 -59.6 -42.89 93.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.871 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.71 -28.01 40.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.5 mmt-85 -78.08 -54.97 5.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.217 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -110.88 -43.06 3.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.168 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.15 168.88 3.89 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.636 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 84.8 m -65.3 153.26 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.741 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.24 162.1 37.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.1 t -77.94 128.67 34.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.96 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.34 30.67 3.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.44 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.04 -49.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 30.9 p -116.57 -0.92 12.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.421 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 62.6 69.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.922 0.391 . . . . 0.0 110.928 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -146.83 143.0 28.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.778 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.4 104.34 1.84 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.702 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.402 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 1.7 mp -72.07 138.23 82.0 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.507 0.194 . . . . 0.0 110.708 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.57 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 94.6 Cg_exo -43.08 171.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.746 2.297 . . . . 0.0 112.844 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.39 -55.2 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.835 2.357 . . . . 0.0 113.828 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.95 21.46 7.52 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.57 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.5 OUTLIER -63.43 139.11 58.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.484 179.768 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.4 t -73.44 108.76 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.039 0.447 . . . . 0.0 111.007 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.416 ' O ' ' N ' ' A' ' 14' ' ' THR . 10.7 p -146.11 160.47 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.85 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.32 134.85 38.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . 0.438 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -114.13 130.57 56.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.923 -179.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.431 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -66.59 96.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.72 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 46.76 -88.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.491 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 138' ' ' ALA . 19.4 p-10 -89.24 -43.89 10.66 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.879 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CD2' ' OD1' ' A' ' 140' ' ' ASP . 5.8 m-85 -89.32 164.14 15.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.989 0.423 . . . . 0.0 111.682 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.438 ' HA ' ' CB ' ' A' ' 137' ' ' ARG . 9.3 p -114.04 149.33 16.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.71 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.44 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 13.7 m-85 -132.3 174.91 9.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.383 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 47.2 m80 -98.22 144.21 27.9 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.879 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.92 62.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.25 -47.95 7.2 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.798 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -84.4 -31.61 24.6 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.445 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 31.7 t80 -56.84 110.19 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.351 . . . . 0.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -161.17 -176.97 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.074 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.5 150.03 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.019 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.73 -29.42 47.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.1 t -110.9 -51.6 6.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.184 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 38.4 m -65.94 -28.09 68.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm 53.15 30.6 10.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -111.1 140.03 45.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -61.78 156.17 21.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.901 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.459 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -117.88 168.11 10.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.844 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.1 168.85 19.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.022 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.6 t -47.96 126.69 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.26 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.47 -25.27 27.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.736 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.63 128.82 37.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.698 0.285 . . . . 0.0 110.656 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -91.38 119.07 31.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.19 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.447 ' CE1' HG22 ' A' ' 10' ' ' VAL . 3.4 p90 -138.71 164.6 29.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.837 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.467 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 76.8 m-85 -112.63 156.84 22.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.862 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.19 113.33 22.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.7 mmt -58.13 177.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -58.28 -49.02 78.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.993 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -74.3 -78.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 40.7 p -177.24 37.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.796 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -93.3 144.93 24.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.445 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -94.59 120.96 35.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 10.0 p -139.73 130.58 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.068 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.6 p -86.13 -172.4 4.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.42 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 1.1 mptp? -63.75 -57.76 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.032 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.38 -29.44 48.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.297 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -90.04 -23.46 21.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.467 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.3 t80 -56.12 -66.12 0.48 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.953 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.26 -44.91 94.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 65.9 m -61.26 -31.5 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -76.07 -51.35 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.69 -67.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . 0.422 ' HB3' ' CE2' ' A' ' 177' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.875 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.1 p . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.873 0.368 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.456 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.62 -176.94 6.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.558 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -150.77 150.61 13.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.352 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' CD1' ' A' ' 163' ' ' PHE . 24.3 t -66.92 146.42 13.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.831 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.7 -179.65 16.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.385 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -57.4 139.39 80.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.475 0.179 . . . . 0.0 110.678 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 16.3 Cg_exo -65.84 140.49 61.38 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.364 2.043 . . . . 0.0 112.493 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -166.14 142.94 5.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.257 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 0.9 OUTLIER -114.89 173.26 6.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.079 0.466 . . . . 0.0 111.333 -179.553 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -34.35 77.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.788 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.401 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 58.18 65.23 3.66 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.417 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -153.6 82.22 0.17 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.622 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -84.2 5.05 27.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.547 0.213 . . . . 0.0 111.225 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 2.9 m-85 69.89 -67.04 0.25 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.36 133.88 3.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.597 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.02 -30.39 26.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.904 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.88 -31.15 71.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.52 -75.09 0.05 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.41 ' HG2' ' CD1' ' A' ' 102' ' ' PHE . 9.1 tp10 -60.06 165.37 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.878 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -75.91 99.95 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.719 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tp -86.0 165.0 17.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.012 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.4 pt -62.96 149.92 9.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.9 m -122.59 106.88 11.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.796 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -80.62 101.76 9.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.505 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -146.17 166.04 27.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.036 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -81.26 157.04 25.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.96 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -102.78 174.47 5.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 p -103.0 35.92 2.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -128.4 161.73 28.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -166.25 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -150.61 80.22 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.12 179.989 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.757 0.313 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.03 168.98 19.03 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.527 2.151 . . . . 0.0 112.156 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 57.85 29.88 18.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.866 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 3.1 tp -98.69 135.18 21.12 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.056 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.35 125.87 18.58 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.35 2.034 . . . . 0.0 111.964 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -102.71 151.14 22.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.153 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.44 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 4.5 t -58.16 137.73 56.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.787 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HB3' ' CZ2' ' A' ' 83' ' ' TRP . . . -62.5 114.65 3.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.172 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.05 25.68 39.81 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.11 -178.9 4.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.931 0.396 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -112.76 -30.74 6.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.182 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.95 -168.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.063 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.404 ' ND1' ' CD2' ' A' ' 71' ' ' LEU . 2.1 p80 -102.36 172.42 6.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.419 ' CD1' ' CE1' ' A' ' 84' ' ' HIS . 12.8 mm -98.06 154.13 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.297 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.414 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -167.02 32.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.68 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -99.17 -179.06 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.894 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.25 -67.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.55 133.65 33.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.067 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.9 mm -138.89 151.42 23.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.111 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 76' ' ' LEU . 6.2 mp -105.05 106.95 17.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.528 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -90.96 115.02 27.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.4 43.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 54.33 36.1 24.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.076 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.47 39.59 11.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -174.03 162.89 3.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.44 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 43.1 p-80 -86.79 117.88 25.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.959 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.429 ' CZ2' ' HB3' ' A' ' 64' ' ' ALA . 86.0 m95 -108.09 124.6 50.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.74 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.419 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.09 174.45 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.964 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -80.06 -38.37 32.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.353 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -91.19 -22.17 20.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.958 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.7 m -95.53 26.76 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 56.0 tp -129.89 88.68 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.835 0.35 . . . . 0.0 111.023 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 161.54 37.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -59.02 147.0 36.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -75.6 -31.07 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -95.8 -60.6 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -60.25 -34.83 74.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.873 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 58.19 31.15 20.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.014 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.0 t -97.86 133.01 23.8 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.99 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.1 118.97 3.1 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.542 2.162 . . . . 0.0 112.557 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -101.86 77.47 1.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.825 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -108.92 38.15 2.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -152.68 -66.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.04 133.86 50.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 t -123.36 128.04 49.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.41 ' CD1' ' HG2' ' A' ' 25' ' ' GLU . 0.4 OUTLIER -112.35 153.64 26.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.2 t -127.43 117.82 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.881 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -149.71 123.96 9.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.47 50.22 45.39 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.482 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 68.91 -67.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 m -58.43 151.2 20.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.952 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.06 134.76 27.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.047 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -122.94 156.38 34.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.937 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.4 p -112.78 135.94 52.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.692 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.447 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -51.97 -35.57 46.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.188 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -45.14 -48.89 12.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.45 -20.8 33.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.85 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.437 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 11.1 t80 -64.13 -34.96 79.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.447 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 40.6 m-85 -65.11 -40.94 95.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.93 0.395 . . . . 0.0 110.756 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -74.8 -56.52 4.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.311 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -73.49 -51.92 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.468 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.437 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 96.6 m-85 -98.53 37.01 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.203 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.99 -143.71 3.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 80.7 m -103.07 155.0 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.711 0.291 . . . . 0.0 110.814 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -151.62 158.42 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.875 0.369 . . . . 0.0 111.191 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.28 136.78 42.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.722 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.46 30.23 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.23 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -58.15 1.47 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 18.0 p -110.37 18.2 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.211 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 54.41 28.37 9.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.778 0.323 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 14.4 tp -100.86 134.71 43.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.829 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.0 110.87 3.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.625 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.43 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 11.4 mt -63.7 139.56 97.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.555 0.216 . . . . 0.0 110.895 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.548 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 91.9 Cg_exo -44.59 172.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.672 2.248 . . . . 0.0 112.598 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.09 -55.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.908 2.405 . . . . 0.0 114.464 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.401 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.32 21.39 7.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.548 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 67.0 mm-40 -61.22 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.471 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.81 112.16 36.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.946 0.403 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.05 161.39 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.733 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.25 134.92 38.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.639 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.91 136.57 52.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.811 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.433 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -72.68 96.32 1.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.861 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 38.1 -89.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.2 m-20 -79.05 -38.5 36.3 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.205 -177.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.41 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.7 m-85 -105.84 168.19 9.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.9 t -122.58 148.12 26.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.514 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.43 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 3.9 m-85 -133.56 170.18 15.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.118 0.485 . . . . 0.0 111.733 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.427 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 0.1 OUTLIER -65.83 168.78 7.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.907 179.729 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.04 -29.96 34.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -91.42 -49.3 6.41 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.11 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.427 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 79.7 m -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.245 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.449 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 2.6 t80 -56.84 114.58 2.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.021 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.1 -177.02 1.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.6 t -97.68 150.07 21.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 21.3 m -66.81 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.283 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.22 -55.88 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.345 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.8 m -65.84 -28.19 68.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.005 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? 54.73 31.65 15.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.69 146.83 46.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.855 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -62.19 154.13 28.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.434 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.7 mm? -112.16 123.27 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.67 16.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.0 t -44.69 133.51 5.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.26 -32.98 6.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.628 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.15 131.06 45.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 0.0 110.812 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.04 113.89 24.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.031 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 9.0 p90 -126.49 153.27 45.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.927 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m-85 -102.16 163.27 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.743 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.6 tp -120.7 112.11 18.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.801 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.14 167.85 2.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.36 -29.65 67.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.5 -79.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.038 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.43 38.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.823 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -105.54 117.58 34.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 1.2 mp -69.4 127.22 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.07 126.66 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.056 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.1 m -58.77 -170.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.811 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -73.42 -55.86 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.71 -43.91 97.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.101 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -59.37 -25.76 64.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.056 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -55.83 -66.09 0.48 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.999 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -56.44 -28.14 58.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.118 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -30.5 43.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.985 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -90.45 -29.18 18.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.246 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm 61.88 174.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.847 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.853 -179.917 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.423 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 10.9 p . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.845 0.355 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -139.51 -177.4 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.639 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 p -155.06 135.7 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.227 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG22 ' CE1' ' A' ' 163' ' ' PHE . 57.5 t -58.9 146.17 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.01 -153.18 8.7 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.664 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 60.0 mt-10 -67.66 141.51 95.19 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.534 0.207 . . . . 0.0 110.748 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 4.0 Cg_endo -83.03 129.91 5.48 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.716 2.277 . . . . 0.0 112.396 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -156.43 155.17 31.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.349 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.2 mt -136.28 173.38 11.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.874 0.369 . . . . 0.0 111.091 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.66 -50.66 32.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.777 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 63.13 88.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.583 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.98 -41.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.424 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 58.4 23.27 10.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.75 0.31 . . . . 0.0 111.026 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 56.95 -172.91 0.08 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.872 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.18 136.76 7.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.89 -31.23 61.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.748 0.308 . . . . 0.0 110.854 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.15 -27.9 61.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.038 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -56.31 -31.18 63.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.025 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.7 OUTLIER -113.01 174.19 6.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -75.98 121.61 22.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.834 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tp -105.13 163.68 12.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.893 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -63.04 146.31 12.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.139 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 50.3 m -113.46 106.84 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.833 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -77.08 101.75 6.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.491 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.03 155.9 42.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.968 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -77.72 152.35 33.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -99.24 -27.52 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.8 m 63.37 37.56 10.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.817 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -124.44 73.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.836 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE2' ' NH1' ' A' ' 73' ' ' ARG . 2.2 t80 -70.55 -44.4 67.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -102.06 141.32 35.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.068 179.957 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 120.638 0.256 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.47 165.53 1.02 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.558 2.172 . . . . 0.0 112.265 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 59.71 31.16 20.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.29 134.93 19.56 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.053 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.14 125.9 18.79 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.405 2.07 . . . . 0.0 112.031 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.5 mtt -99.19 135.94 39.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -58.03 147.54 29.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.654 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.477 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -62.12 114.82 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.068 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 97.37 -22.24 41.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.967 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.76 -178.82 6.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -144.4 46.88 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.01 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -150.68 -83.35 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.014 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 176.03 -177.55 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.933 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.417 HG13 ' CD2' ' A' ' 82' ' ' HIS . 7.7 mm -126.93 153.72 36.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -172.79 35.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.886 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -100.3 -179.54 4.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.938 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' NH1' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -81.73 -79.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.92 132.75 38.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.5 mm -136.03 152.48 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.115 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' LEU . 6.0 mp -106.97 106.91 17.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.437 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -90.84 120.83 32.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' A' ' 83' ' ' TRP . . . -153.87 154.75 34.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.114 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.411 HD11 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.74 37.72 28.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.21 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.72 40.68 12.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.911 0.386 . . . . 0.0 111.145 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -176.64 159.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.822 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.417 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 29.9 p-80 -85.17 117.93 24.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.477 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 77.9 m95 -106.93 122.92 47.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.608 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.98 151.84 11.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.894 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -59.01 -35.89 74.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.843 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mttt -91.15 -48.9 6.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.94 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 21.0 m -58.48 -27.95 64.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.117 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.6 tp -72.17 88.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.886 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -134.96 159.29 41.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 53.3 t -60.75 147.03 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.79 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -62.59 -39.91 95.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.506 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -99.7 -63.12 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.434 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.2 m -56.36 -33.23 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.314 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 53.68 24.98 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.026 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -86.03 161.51 49.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.261 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.18 118.96 5.58 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.594 2.196 . . . . 0.0 112.309 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 mp -126.83 74.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.809 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -116.64 30.98 7.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -137.43 -55.04 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.07 47.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.933 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.6 t -113.02 163.87 14.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.834 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.451 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 1.9 t80 -165.32 120.95 1.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.1 p -151.98 172.35 16.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -167.43 123.99 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.5 -87.1 1.31 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.471 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -150.77 36.25 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.883 0.373 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.7 m -156.23 142.5 18.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.1 p -112.6 115.98 51.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -130.08 121.03 25.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.84 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.0 p -49.63 173.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.224 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 11.7 mtpt -78.16 -28.79 48.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.44 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.4 t70 -52.91 -52.91 56.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.264 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -84.05 -20.7 32.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.277 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.484 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 14.4 t80 -61.48 -33.3 73.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.0 110.758 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.6 m-85 -59.71 -45.34 92.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.77 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -74.68 -27.02 60.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.005 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -64.2 -54.99 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.223 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -117.03 -42.99 2.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -56.93 171.89 2.46 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -58.93 149.22 27.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.789 0.328 . . . . 0.0 110.931 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -150.88 162.13 41.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 16.1 t -79.0 155.8 28.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.953 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -111.09 -20.56 12.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.363 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -78.22 -58.03 3.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.05 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.26 -12.08 21.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.186 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 36.75 12.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.414 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.5 tp -109.49 144.17 38.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.44 104.25 0.74 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.553 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.465 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 64.8 mt -61.42 140.38 94.75 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.638 0.256 . . . . 0.0 110.987 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.543 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 83.8 Cg_exo -43.97 170.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.874 2.383 . . . . 0.0 112.814 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.35 -55.58 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.479 2.12 . . . . 0.0 114.831 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.403 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.63 21.48 7.07 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.543 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 84.2 mm-40 -59.57 -178.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.791 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.52 114.35 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.071 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' THR . 11.4 p -157.05 164.56 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.68 34.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.346 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.61 133.52 49.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.018 -179.267 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -67.96 96.31 0.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.761 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.97 -89.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.4 t70 -80.64 -39.53 27.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.377 -177.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 138' ' ' ALA . 2.9 m-85 -106.65 173.35 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.852 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.432 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 7.9 p -126.65 149.0 31.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.604 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.423 ' CE1' ' HB2' ' A' ' 138' ' ' ALA . 3.6 m-85 -131.88 158.88 40.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 111.364 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 76.7 m80 -71.53 137.92 48.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.042 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.428 ' N ' HG21 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -62.54 -17.79 60.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.345 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.33 -37.37 21.7 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.393 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 7.7 p -96.43 -19.05 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.455 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 4.8 t80 -60.1 119.53 8.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.708 0.29 . . . . 0.0 110.804 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.02 -176.87 1.77 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.207 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.67 150.06 25.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 5.4 m -68.98 -30.16 45.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.143 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.48 -52.61 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.173 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 13.8 m -66.04 -28.1 68.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.005 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 58.01 34.58 24.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.995 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -115.47 137.33 52.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -64.63 155.25 33.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.025 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.469 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.1 mm? -115.44 164.25 14.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.682 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 169.34 18.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.418 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 m -42.79 122.19 2.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.71 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.24 -22.87 36.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.724 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.35 128.88 37.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 110.774 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -91.31 115.35 27.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.426 ' CE1' HG22 ' A' ' 10' ' ' VAL . 8.3 p90 -137.44 169.26 18.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.021 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.495 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 87.2 m-85 -115.51 171.01 7.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.93 116.45 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.821 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mtp -72.26 -176.24 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.976 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.01 -26.22 31.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.18 30.33 2.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.049 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 12.9 p 58.32 45.35 17.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.025 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.06 155.3 19.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.455 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -105.06 123.47 47.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.9 p -142.54 125.26 13.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.06 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 23.3 p -78.53 -171.0 2.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.951 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -79.1 -30.18 43.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.149 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.55 -34.94 79.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.389 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -104.14 4.11 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.594 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 8.8 t80 -65.93 -66.12 0.59 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 110.778 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -59.12 -26.06 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.032 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.5 m -72.98 -27.69 61.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.093 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.35 -32.12 12.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.914 0.387 . . . . 0.0 110.738 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . 0.425 ' HE3' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER 179.29 171.54 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.929 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.876 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.434 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.8 p . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.881 0.372 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.461 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -154.98 -173.12 4.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.627 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -155.06 144.8 13.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.223 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.427 HG22 ' CE1' ' A' ' 163' ' ' PHE . 32.6 t -67.79 146.2 13.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.688 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -129.92 -176.18 14.33 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.629 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 3.6 mm-40 -59.85 148.2 76.95 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 120.573 0.225 . . . . 0.0 110.775 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 4.6 Cg_exo -77.92 137.02 15.38 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.642 2.228 . . . . 0.0 112.586 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.01 142.85 5.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.985 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.411 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.7 OUTLIER -120.53 173.6 7.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.202 0.525 . . . . 0.0 111.445 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -28.84 64.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.017 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 58.72 56.28 26.16 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.304 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.52 -50.17 70.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.6 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 70.08 -64.81 0.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.48 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER 62.85 163.14 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.907 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.46 -170.94 44.1 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.577 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -59.19 -28.47 66.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 0.0 111.078 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -56.64 -29.47 62.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.52 -75.28 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' CG ' ' CE2' ' A' ' 102' ' ' PHE . 52.4 mm-40 -113.57 172.83 6.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.845 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ptp85 -76.04 144.49 40.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tp -111.99 163.68 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.6 pt -62.93 161.83 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.176 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -130.81 106.85 8.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.3 101.8 7.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.534 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.62 150.36 40.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.417 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 2.8 mt-10 -68.48 157.06 36.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -123.7 19.5 9.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.226 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.6 t 43.95 31.21 0.48 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.382 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -120.24 162.3 19.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -177.14 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -114.04 107.3 15.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.956 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.076 179.982 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.727 0.299 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.38 161.35 46.23 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.497 2.132 . . . . 0.0 112.246 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 60.2 33.84 21.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.438 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -108.94 134.63 20.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.17 125.99 19.0 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.435 2.09 . . . . 0.0 112.119 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.38 140.51 30.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.107 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.497 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 14.0 p -58.07 164.2 2.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.975 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' HB3' ' CZ2' ' A' ' 83' ' ' TRP . . . -86.46 114.59 23.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.515 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.83 -69.81 0.46 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.6 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.497 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 14.1 p -105.25 153.77 21.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -74.52 87.13 2.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.21 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -179.22 133.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.438 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 12.6 p80 -72.1 143.62 48.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.453 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 4.9 mm -70.76 152.08 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -174.21 35.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.91 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -107.53 162.84 13.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.925 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -59.64 -74.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.417 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -82.91 120.87 26.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.021 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.32 146.68 28.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.205 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.7 106.67 17.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.435 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -91.48 127.61 36.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -166.68 165.24 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.188 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.2 mt 59.25 37.25 23.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.109 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.83 29.52 17.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.014 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -169.89 -179.15 3.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 25.9 p-80 -97.2 124.63 41.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.87 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.427 ' CZ2' ' HB3' ' A' ' 64' ' ' ALA . 37.4 m95 -115.77 130.58 56.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.718 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.453 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.99 170.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.909 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 p -80.02 -40.07 28.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.0 mttm -90.57 -26.85 19.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.4 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 68.4 m -71.06 -30.27 66.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.971 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.4 tp -76.6 80.3 3.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.852 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -135.94 153.18 51.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.71 135.48 48.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.766 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -29.21 68.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.063 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.24 -62.92 1.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.146 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.9 m -58.28 -34.98 71.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 55.33 23.72 5.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.112 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.5 m -85.97 156.37 57.9 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.216 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.55 118.95 5.92 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.497 2.131 . . . . 0.0 112.308 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.0 mp -104.02 65.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -98.05 30.25 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.111 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -140.26 -51.94 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.25 174.36 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.2 t -157.01 141.6 16.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.449 ' CE2' ' CG ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -133.98 172.04 13.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -147.61 155.26 41.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -170.28 124.04 0.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.23 -90.62 0.36 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.444 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -153.87 36.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 m -153.21 153.08 32.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.3 p -85.71 116.02 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.04 160.19 20.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -97.98 171.22 8.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.743 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 1.5 mttt -78.16 -32.9 50.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.477 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.5 -58.08 7.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.543 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -72.92 -20.83 61.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 4.4 t80 -64.38 -33.55 76.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 110.953 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 4.9 m-85 -79.15 -35.24 42.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.01 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -84.96 -59.05 2.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.284 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -71.54 -47.36 55.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.387 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -98.07 37.03 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.361 . . . . 0.0 111.064 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -149.06 -178.95 24.54 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.36 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 72.4 m -60.11 153.53 21.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.794 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -144.44 174.27 11.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.126 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 41.8 t -93.4 130.76 39.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.799 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.81 29.53 3.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.111 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.454 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.12 -53.27 1.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.26 -8.34 14.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.323 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 64.07 64.73 0.73 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.934 0.397 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 5.2 tp -134.63 175.77 9.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -99.15 99.15 2.08 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.718 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.424 HG13 ' CE1' ' A' ' 144' ' ' HIS . 1.7 mp -74.45 138.14 74.6 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.424 0.154 . . . . 0.0 110.692 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.594 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 89.6 Cg_exo -44.4 173.2 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.596 2.197 . . . . 0.0 112.59 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.69 -55.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.861 2.374 . . . . 0.0 113.814 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.23 21.72 11.63 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.594 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.6 OUTLIER -67.95 137.55 55.25 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.584 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.14 108.77 5.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.43 ' O ' ' N ' ' A' ' 14' ' ' THR . 11.3 p -143.08 158.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.773 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 134.81 39.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.893 0.378 . . . . 0.0 110.777 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -104.96 112.92 26.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.893 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 139' ' ' GLN . . . -79.82 146.92 32.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.795 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 138' ' ' ALA . 18.0 pm0 42.64 -142.28 0.11 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.334 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -89.74 35.26 0.83 Allowed 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -151.41 169.0 23.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.914 0.388 . . . . 0.0 111.039 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.7 p -103.57 148.65 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.047 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.454 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 6.9 m-85 -126.89 175.06 8.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.967 0.413 . . . . 0.0 111.21 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.8 m80 -104.95 136.85 43.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.75 -22.4 23.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 177.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.33 -36.0 14.1 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.674 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -97.14 1.65 50.18 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.433 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.5 t80 -86.03 115.84 23.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.777 0.323 . . . . 0.0 110.645 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.0 -176.95 1.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.259 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.54 150.21 20.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.025 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 14.2 m -67.44 -27.29 38.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.289 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 28.3 t -104.11 -55.7 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.424 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 30.1 m -65.94 -28.04 68.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.981 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm 57.53 28.5 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.999 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 34.2 mtm180 -121.74 147.75 45.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -66.76 153.43 43.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.038 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.451 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.1 mm? -115.89 139.93 49.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.728 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -107.37 167.0 10.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.163 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 t -46.79 138.55 6.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.33 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.33 -32.59 6.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.499 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -63.81 128.92 37.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.766 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -93.7 116.18 28.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.994 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.461 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 13.8 p90 -126.91 166.28 17.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.917 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 23.4 m-85 -117.27 171.17 8.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.144 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.2 tp -124.38 111.02 15.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.429 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 2.8 mmt -60.94 -89.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.264 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -83.23 -49.16 9.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.802 0.334 . . . . 0.0 111.097 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.3 t0 176.82 -38.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.748 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 33.7 p -115.4 30.76 7.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.9 mtt180 -120.48 132.21 55.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.453 ' CD1' ' CE2' ' A' ' 143' ' ' TYR . 0.2 OUTLIER -103.84 123.69 47.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.837 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.4 p -145.07 118.92 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.094 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.3 m -55.37 -176.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.015 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -69.31 -49.0 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.17 84.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -59.45 -25.95 64.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.937 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -54.54 -65.31 0.6 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.018 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -54.13 -23.49 14.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.304 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.0 m -87.07 -26.77 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -52.07 4.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.487 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 171.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.927 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 -179.959 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.424 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 11.0 p . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.845 0.355 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.446 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -146.1 -179.3 6.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.679 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.02 135.38 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.29 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG21 ' CE1' ' A' ' 163' ' ' PHE . 41.3 t -59.03 146.27 9.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.489 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -136.12 -159.75 8.57 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.743 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.33 123.27 69.35 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.514 0.197 . . . . 0.0 110.901 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.03 138.42 72.96 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.309 2.006 . . . . 0.0 112.263 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -166.03 148.56 7.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.414 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 1.1 mt -116.84 173.4 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.294 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -37.09 77.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.866 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 57.44 81.54 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.543 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.84 -72.29 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 60.67 86.87 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.782 0.325 . . . . 0.0 110.826 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.524 ' CZ ' ' CE1' ' A' ' 115' ' ' PHE . 29.7 p90 -59.79 -44.47 93.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.036 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.436 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 57.39 -120.91 23.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.563 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -83.94 -23.86 30.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.733 0.301 . . . . 0.0 111.168 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.99 -29.98 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.175 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.19 -73.55 0.39 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.874 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.403 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 19.9 tp10 -120.99 163.49 18.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 147.87 38.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -101.58 165.13 11.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.972 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.403 ' CD1' ' N ' ' A' ' 99' ' ' GLU . 4.1 pt -62.97 144.01 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.147 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.6 m -110.29 106.85 16.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 101.83 10.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.552 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.35 157.16 44.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.996 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -87.04 157.05 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -110.83 -178.09 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 p -120.64 37.22 4.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -90.42 -54.03 4.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.0 t80 68.5 -68.1 0.18 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.9 -65.26 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.211 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.767 0.318 . . . . 0.0 110.888 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -51.72 164.7 0.91 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.554 2.169 . . . . 0.0 112.293 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 59.31 31.2 20.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.422 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.3 tp -109.79 135.0 20.46 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.56 125.95 18.66 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.379 2.053 . . . . 0.0 112.144 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.54 139.34 30.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 13.9 p -57.73 164.22 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . . . -86.3 114.67 23.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.44 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.45 -75.04 0.38 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.607 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 12.2 p -98.78 152.33 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 110.941 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 87.25 1.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.02 136.85 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.422 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.5 p80 -73.76 151.48 40.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.972 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.456 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -79.69 153.51 4.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.908 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.403 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.6 OUTLIER -173.41 35.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -109.3 163.05 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -77.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.42 120.57 22.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.9 mm -122.83 154.02 27.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.205 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -112.2 106.83 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.369 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -90.85 129.39 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.967 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -161.41 162.78 30.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.182 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.401 ' CD1' ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 55.01 36.13 26.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.14 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 62.5 30.19 17.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.012 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -164.03 170.11 17.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 30.8 p-80 -88.38 120.94 30.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.425 ' CZ2' ' HB2' ' A' ' 64' ' ' ALA . 47.4 m95 -110.17 130.04 55.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.456 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.54 174.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.7 t -79.99 -42.17 24.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -90.35 -29.75 17.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.956 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.6 m -69.63 -31.41 69.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.4 ' CD1' ' CB ' ' A' ' 83' ' ' TRP . 7.3 tp -72.82 77.52 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -137.05 165.46 25.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.809 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.59 147.07 39.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -28.49 67.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.013 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -111.49 -57.24 2.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 26.9 m -57.76 -46.1 85.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.067 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 94' ' ' HIS . 10.5 t-160 58.31 21.7 8.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 13.3 m -86.47 155.69 56.74 Favored Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.118 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 118.98 5.95 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.495 2.13 . . . . 0.0 112.081 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.4 mp -107.59 64.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.805 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -100.04 30.66 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.112 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.403 ' N ' ' CD1' ' A' ' 28' ' ' ILE . 15.3 mm-40 -138.48 -47.23 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.58 148.12 26.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.816 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.2 128.24 18.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.415 ' CD1' ' HG3' ' A' ' 111' ' ' LYS . 0.6 OUTLIER -111.52 172.03 7.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.807 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 p -152.24 122.72 7.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.946 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.13 124.06 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.13 -102.02 2.01 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.495 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -143.56 34.92 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -153.33 152.46 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.98 124.47 36.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.058 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -121.01 143.31 49.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.002 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.0 p -87.91 153.54 21.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 29.6 mtpt -56.21 -34.69 66.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.927 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -63.43 -28.05 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -83.91 -22.95 31.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.202 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.516 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 8.8 t80 -73.86 -49.81 23.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.029 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.524 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 m-85 -51.88 -40.23 60.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.853 0.359 . . . . 0.0 111.239 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -85.07 -64.11 1.21 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.465 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -59.91 -49.27 78.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.58 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -109.26 37.02 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -164.39 168.1 38.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.6 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.41 ' CG2' ' CG1' ' A' ' 142' ' ' VAL . 85.8 m -61.55 154.99 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.69 0.281 . . . . 0.0 110.659 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -162.11 161.15 28.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 111.168 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.02 137.27 56.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.84 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.6 29.76 3.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -58.18 1.47 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.292 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 17.1 p -110.85 8.15 22.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.46 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 59.51 29.44 19.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.697 0.284 . . . . 0.0 111.069 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 tp -92.18 121.69 33.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.48 112.08 3.42 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.763 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.425 HG21 ' HD2' ' A' ' 130' ' ' PRO . 4.2 mt -71.77 132.92 84.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.614 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 76.1 Cg_exo -47.37 176.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.297 1.998 . . . . 0.0 112.592 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.03 -52.13 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.113 2.542 . . . . 0.0 113.632 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.03 22.02 7.39 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.614 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -55.88 -169.94 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.678 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.14 108.81 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.019 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.1 p -157.05 160.93 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.61 134.87 39.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.487 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 135.87 52.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.878 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.422 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -71.21 96.67 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.977 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.65 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.359 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 138' ' ' ALA . 3.2 t70 -90.55 -46.07 8.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.782 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.644 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.41 ' CG1' ' CG2' ' A' ' 120' ' ' THR . 10.5 p -117.1 150.61 19.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.679 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -132.16 174.95 9.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.43 165.24 23.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.913 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.3 mp -81.07 -32.32 34.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -91.36 -49.29 6.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.727 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 69.3 m -53.55 -29.6 37.71 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.127 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.416 ' CZ ' HD23 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.89 114.68 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.086 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.19 154.24 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.035 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.56 149.96 28.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.9 -28.22 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.7 t -109.07 -56.7 4.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.338 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 31.7 m -65.92 -28.13 68.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.172 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 68.5 mttt 49.93 48.57 21.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -118.35 136.66 53.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.026 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.2 149.51 19.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.319 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -114.9 162.26 17.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.499 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 172.56 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 3.5 m -45.43 125.34 5.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.398 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.87 -22.76 37.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.694 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -62.19 128.9 38.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 110.765 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -87.98 123.42 32.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.94 0.4 . . . . 0.0 111.098 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.446 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 8.3 p90 -144.0 156.4 44.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 47.4 m-85 -108.62 171.1 7.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.34 33.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.853 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 6.7 mmt -81.6 166.97 19.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -65.86 -28.43 68.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -97.68 29.23 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.2 57.04 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -125.66 128.29 47.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 163' ' ' PHE . 3.0 mp -78.6 133.29 37.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.5 p -145.06 137.27 21.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.935 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.6 p -81.56 169.13 17.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -59.13 -51.79 68.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.6 -25.47 52.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.293 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -96.81 -14.54 21.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.381 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.401 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 7.2 t80 -57.58 -66.0 0.54 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.371 . . . . 0.0 110.911 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.36 -28.49 70.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.139 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.9 m -75.33 -33.3 61.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.062 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -88.9 -49.58 6.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.216 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm 62.34 175.36 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.927 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.933 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.422 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 13.2 p . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.852 0.358 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.42 ' HE3' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -157.21 -170.61 3.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.667 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.5 p -155.04 147.59 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 163' ' ' PHE . 22.5 t -61.85 146.31 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.652 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.4 -163.54 10.49 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.521 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.69 130.04 84.26 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.449 0.166 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -60.67 146.91 96.37 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.269 1.979 . . . . 0.0 112.399 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.13 160.56 24.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.465 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.43 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.2 OUTLIER -144.02 173.58 11.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.066 0.46 . . . . 0.0 111.36 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -39.85 94.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.403 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 57.39 83.02 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.642 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.34 -126.01 3.24 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.32 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 170.51 -33.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 110.826 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 3.4 t80 69.18 161.67 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.869 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -111.02 127.14 8.1 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.627 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -84.05 -30.42 26.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.875 0.369 . . . . 0.0 110.936 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -58.07 -24.51 58.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.114 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.66 -30.13 54.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.06 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.9 OUTLIER -109.14 175.99 5.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.908 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.7 mmt85 -94.38 99.97 12.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.96 161.34 30.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.864 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . 0.403 ' CG2' ' CD2' ' A' ' 88' ' ' LEU . 6.2 pt -62.99 138.52 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 m -100.52 106.84 18.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.2 mtm-85 -84.69 101.73 12.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.377 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 151.43 51.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.88 96.97 3.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.34 116.15 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -65.59 79.22 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -151.8 78.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -96.02 -31.49 13.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -127.42 115.66 19.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.125 179.939 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.688 0.28 . . . . 0.0 110.851 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.37 164.07 35.56 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.562 2.175 . . . . 0.0 112.209 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 59.08 31.61 21.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.857 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.422 HG23 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -106.56 134.7 19.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.112 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.17 125.99 18.33 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.388 2.059 . . . . 0.0 112.084 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.9 139.81 30.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.069 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.462 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 14.7 p -57.54 164.14 2.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.958 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.411 ' HB2' ' CD2' ' A' ' 83' ' ' TRP . . . -86.31 114.61 23.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.481 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.06 -71.36 0.44 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.601 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.462 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 12.8 p -103.56 152.94 21.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.774 0.321 . . . . 0.0 110.981 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.45 87.2 2.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.11 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -178.79 135.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' A' ' 60' ' ' ILE . 10.9 p80 -71.39 143.47 50.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 3.4 mm -68.76 147.62 12.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.407 ' CD2' ' CE1' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.7 35.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.929 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -111.39 144.6 40.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.91 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.403 ' HG2' ' N ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -56.94 -34.26 67.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.109 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.403 ' N ' ' HG2' ' A' ' 73' ' ' ARG . 2.0 m-85 -106.19 112.03 24.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mm -132.61 147.48 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 111.253 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -109.82 107.35 17.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.286 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -90.77 122.5 33.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.055 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -164.71 167.1 19.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.118 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mt 62.95 37.04 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 29.18 17.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.065 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -170.62 -179.56 2.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 26.7 p-80 -97.99 124.45 42.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.972 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.411 ' CD2' ' HB2' ' A' ' 64' ' ' ALA . 42.2 m95 -116.54 130.8 56.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.779 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.71 172.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p -79.57 -40.62 29.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -91.0 -28.47 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.54 -31.15 68.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.993 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.403 ' CD2' ' CG2' ' A' ' 28' ' ' ILE . 5.2 tp -80.86 94.38 6.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.976 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -144.07 156.77 44.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 23.7 t -60.0 147.13 40.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.805 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.3 m -74.21 -28.88 61.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.173 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -101.39 -63.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.135 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 37.2 m -60.07 -30.69 69.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.097 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 57.31 23.18 8.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.81 156.31 58.38 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.247 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.57 118.93 5.96 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.525 2.15 . . . . 0.0 112.297 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -103.8 86.69 2.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -114.84 30.5 7.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.092 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -140.03 -47.37 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -150.81 146.46 26.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.811 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 14.5 t -126.13 158.92 34.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.423 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.62 119.98 5.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.8 p -139.11 150.86 46.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.24 124.0 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.828 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -114.4 4.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.535 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -123.87 32.99 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 0.0 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.2 m -157.69 166.89 31.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.5 p -129.33 115.98 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.077 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.2 OUTLIER -131.7 132.42 43.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -52.06 167.02 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.423 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 1.7 mtmt -67.19 -30.43 70.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.423 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 4.8 t70 -55.2 -48.86 73.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -72.23 -20.9 61.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.051 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 118' ' ' PHE . 10.4 t80 -66.4 -41.05 89.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.951 0.405 . . . . 0.0 110.809 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.423 ' CZ ' ' HD2' ' A' ' 111' ' ' LYS . 6.4 m-85 -67.77 -26.16 65.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.944 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -43.81 25.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.21 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.445 ' NH1' ' CD2' ' A' ' 109' ' ' TYR . 14.4 ptp180 -79.27 -47.24 16.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.382 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 114' ' ' PHE . 76.3 m-85 -84.52 -43.02 14.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.99 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.94 167.89 40.57 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.574 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.8 m -59.58 152.93 20.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.6 172.24 14.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.069 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.2 t -63.77 138.57 58.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.71 29.53 2.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.995 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.22 -58.13 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.963 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 16.3 p -108.24 12.66 26.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.289 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 54.12 30.0 11.33 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.87 0.367 . . . . 0.0 111.083 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.6 tp -94.1 138.65 31.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.909 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -65.4 130.79 34.98 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 22.3 mt -87.0 126.82 61.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.435 0.159 . . . . 0.0 110.817 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.603 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 86.0 Cg_exo -44.43 173.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.72 2.28 . . . . 0.0 112.706 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.87 -55.12 0.22 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.866 2.377 . . . . 0.0 113.684 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.403 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.2 21.42 7.36 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.296 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.603 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.0 OUTLIER -59.02 138.54 57.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.388 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -78.14 108.64 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.988 0.423 . . . . 0.0 110.891 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.9 p -143.12 161.04 17.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.78 134.98 39.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.929 0.395 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.19 157.89 16.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.956 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.419 ' HB3' ' CD1' ' A' ' 143' ' ' TYR . . . -100.6 96.75 7.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.756 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 57.38 -86.52 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.497 0.665 . . . . 0.0 111.821 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -100.22 -48.97 4.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.783 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -82.59 161.78 22.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.628 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.6 p -106.31 151.28 8.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.672 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 138' ' ' ALA . 19.5 m-85 -129.68 174.97 9.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.036 0.446 . . . . 0.0 111.394 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 160.73 27.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.773 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -81.03 -31.3 34.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.857 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -91.27 -49.28 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.913 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 74.3 m -53.35 -30.14 37.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.231 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.444 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 1.3 t80 -56.84 116.16 3.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.099 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.16 -177.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.926 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.0 t -99.88 150.04 22.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 6.0 m -65.91 -26.37 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.314 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 25.7 t -107.89 -55.76 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.371 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.01 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 53.9 34.98 20.65 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.159 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -124.68 143.93 50.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -59.01 154.06 16.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.447 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.6 mm? -111.77 123.05 49.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -99.25 158.18 15.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.7 t -44.84 132.48 6.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.534 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 106.81 -32.38 7.32 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.548 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.02 133.61 46.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.834 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -87.97 116.12 25.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.027 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 10' ' ' VAL . 8.2 p90 -126.5 144.65 50.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.422 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 5.0 m-85 -96.97 147.39 24.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 tp -106.53 110.94 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.6 mmt -72.52 150.01 43.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -59.36 -28.76 67.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.012 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -97.48 36.2 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.996 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 3.1 p 49.97 83.6 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.184 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -156.43 120.38 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.444 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 1.2 mp -80.12 126.5 31.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.09 127.87 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 52.6 m -58.34 -173.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.411 ' HE3' ' CE2' ' A' ' 164' ' ' TYR . 0.1 OUTLIER -72.8 -49.59 29.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -68.2 -44.12 76.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.119 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -58.81 -23.61 60.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.37 -65.97 0.5 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.46 -27.89 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.14 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.3 m -78.56 -30.44 46.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.065 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.88 16.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.257 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm 61.32 175.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.797 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.92 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.446 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.895 0.378 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.448 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -158.08 -175.87 5.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.527 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.0 p -155.03 131.82 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.185 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.435 HG23 ' CE1' ' A' ' 163' ' ' PHE . 57.8 t -55.71 146.3 5.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.667 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.5 -161.42 10.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.513 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -61.68 139.46 95.3 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.512 0.196 . . . . 0.0 110.759 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.69 132.66 12.2 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.572 2.181 . . . . 0.0 112.193 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.02 155.74 25.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.479 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 1.2 mt -131.6 173.53 11.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.175 0.512 . . . . 0.0 111.525 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.6 -32.14 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.745 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.402 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 56.59 58.57 13.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.531 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -91.49 -75.34 1.3 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.563 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 65.56 77.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.478 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.8 OUTLIER -57.89 -170.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.65 -163.28 34.46 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.541 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -84.0 -31.84 25.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.753 0.311 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -59.58 -26.75 65.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.051 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.23 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.03 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 13.0 mm-40 -103.28 175.25 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.966 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -84.15 134.32 34.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.857 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -95.43 165.01 12.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.969 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 9.4 pt -62.91 134.91 27.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.166 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -95.16 106.89 18.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.967 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.21 101.76 6.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.414 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.07 154.19 43.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -79.01 156.99 28.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -115.25 116.62 28.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -75.19 89.52 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.07 -73.43 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 68.13 -69.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.994 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.28 107.65 5.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.07 -179.981 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.647 0.26 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.27 165.14 27.79 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.489 2.126 . . . . 0.0 112.146 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 58.66 30.03 19.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.794 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.425 HG22 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -103.57 135.33 19.39 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.92 125.96 18.43 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.35 2.034 . . . . 0.0 112.062 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.99 163.55 22.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.088 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.3 t -73.82 154.71 39.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.423 ' HB3' ' CE3' ' A' ' 83' ' ' TRP . . . -82.55 114.65 21.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.498 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.65 -50.03 0.81 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.453 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.5 p -108.64 -179.0 3.74 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.847 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -108.0 75.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.012 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.25 132.5 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.425 ' CD2' HG22 ' A' ' 60' ' ' ILE . 9.3 p80 -63.85 134.84 55.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.422 HD13 ' CE1' ' A' ' 84' ' ' HIS . 4.7 mm -59.65 151.54 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.937 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.58 36.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -107.16 158.23 17.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -60.13 -74.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.6 121.15 24.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.995 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.2 mm -124.86 151.49 30.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.205 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 mp -109.74 106.98 16.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.392 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -90.75 124.38 35.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.04 159.9 35.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.13 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 58.31 36.44 25.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.44 32.7 16.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.04 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 mtm-85 -170.02 169.93 7.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.419 ' CD2' HG13 ' A' ' 70' ' ' ILE . 21.4 p-80 -86.42 127.41 34.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.423 ' CE3' ' HB3' ' A' ' 64' ' ' ALA . 53.5 m95 -119.81 123.71 44.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.8 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.422 ' CE1' HD13 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.78 172.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.992 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -77.11 -47.8 19.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.855 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -85.91 -25.81 25.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 84.5 m -73.82 -28.2 61.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.9 tp -80.79 90.17 5.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.002 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -143.71 154.83 43.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 8.4 t -59.85 147.06 39.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.847 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.4 m -73.51 -28.78 62.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.154 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -101.43 -63.05 1.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.189 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 30.0 m -59.83 -29.8 68.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.106 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.66 22.72 8.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.015 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -84.81 156.47 61.2 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.138 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.98 5.92 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.534 2.156 . . . . 0.0 112.366 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.1 mp -104.88 61.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.828 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.32 40.51 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -151.7 -46.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -148.23 143.61 27.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.725 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.3 t -119.16 156.05 30.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.428 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -154.82 119.97 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.775 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 1.2 t -96.73 160.53 14.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.996 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.448 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 0.0 OUTLIER -164.67 123.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.52 -131.86 51.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -98.85 31.62 2.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.885 0.374 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.3 m -162.66 173.73 13.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.797 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 13.8 p -102.15 115.86 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.35 120.94 36.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.857 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.1 p -60.33 172.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.13 -32.19 50.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.428 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -51.74 -57.99 7.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.424 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -74.15 -20.67 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.478 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 t80 -62.19 -26.36 68.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.94 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 3.7 m-85 -78.97 -39.61 33.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.036 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -85.04 -51.03 6.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.253 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 -73.35 -51.35 17.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.448 ' CE2' ' CD ' ' A' ' 104' ' ' ARG . 5.1 m-85 -102.79 37.04 2.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.108 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.65 162.96 32.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.449 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 74.8 m -58.76 152.16 19.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.761 0.315 . . . . 0.0 110.959 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 126' ' ' GLN . 0.1 OUTLIER -169.01 147.88 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 38.0 t -65.44 130.84 44.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.922 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -95.67 23.45 6.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -41.61 2.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.978 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.9 m -106.94 -12.9 15.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.293 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER 63.95 30.27 14.23 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 0.0 110.784 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -106.61 137.65 44.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.61 102.28 0.8 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.646 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.447 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 6.7 mt -60.26 140.38 91.39 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.493 0.187 . . . . 0.0 110.801 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.592 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 84.1 Cg_exo -47.34 173.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.468 2.112 . . . . 0.0 112.31 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.402 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 63.5 Cg_endo -77.39 -54.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.47 2.113 . . . . 0.0 113.85 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.88 21.59 10.63 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.592 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 2.1 pt20 -59.02 140.01 56.21 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.512 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -80.12 108.74 13.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.934 0.397 . . . . 0.0 110.727 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.2 p -154.64 158.91 3.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.218 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -96.91 137.98 35.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.653 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.85 131.09 54.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.768 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -59.76 96.53 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.662 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 54.03 -86.47 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.391 0.615 . . . . 0.0 111.61 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.9 m-20 -99.42 -48.47 4.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -80.63 166.59 20.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.585 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.7 p -127.15 157.24 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.647 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' A' ' 169' ' ' SER . 22.7 m-85 -153.58 161.79 41.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.4 . . . . 0.0 111.324 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.419 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 77.0 m80 -60.62 145.4 49.15 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.308 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -17.95 65.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -81.94 -49.02 10.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.946 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 15.1 p -81.06 -29.87 34.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.172 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.431 ' CZ ' HD23 ' A' ' 171' ' ' LEU . 20.0 t80 -63.08 99.07 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.84 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -162.0 175.28 11.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.098 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 47.1 t -78.72 150.21 32.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . 0.401 ' CG1' ' NH1' ' A' ' 170' ' ' ARG . 34.5 m -72.26 -39.82 64.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.419 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.45 -57.23 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.549 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 35.2 m -65.89 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.9 34.36 23.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 54.0 mtm-85 -128.98 151.41 49.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -75.71 150.42 37.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.948 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.2 mm? -100.88 171.49 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.811 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.03 167.18 23.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.938 0.399 . . . . 0.0 111.275 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.2 m -43.27 129.14 4.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.644 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.19 -22.94 33.95 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.828 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -67.94 129.03 38.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.86 0.362 . . . . 0.0 110.81 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -88.02 123.64 32.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.033 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.448 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 7.3 p90 -141.45 162.39 35.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.072 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 50.9 m-85 -110.93 171.03 7.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.908 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -131.77 110.97 11.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.9 mmt -73.53 -89.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.137 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -83.2 -49.2 9.69 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.84 0.352 . . . . 0.0 110.963 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -173.91 -59.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.675 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.427 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . 32.8 t -93.3 -22.99 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . 0.401 ' NH1' ' CG1' ' A' ' 151' ' ' VAL . 2.9 mmm180 -56.41 102.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.13 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -91.51 125.77 36.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.826 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 11.8 p -145.03 123.36 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.066 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 5.1 m -66.76 -172.44 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.056 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 1.4 mtpm? -86.08 -35.99 19.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.776 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.59 67.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.091 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.07 4.09 35.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.457 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 21.7 t80 -62.01 -65.98 0.61 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.059 0.457 . . . . 0.0 110.978 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -47.02 -28.63 1.74 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.492 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -30.57 57.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.975 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.06 -20.78 17.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.526 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.46 -178.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.816 -179.985 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HB ' ' CZ ' ' A' ' 164' ' ' TYR . 14.6 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.844 0.354 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.27 -165.37 1.01 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.363 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 p -155.06 144.7 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 0.0 111.369 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.427 HG21 ' CE1' ' A' ' 163' ' ' PHE . 47.8 t -62.06 146.1 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.169 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.68 -159.37 10.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.949 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -68.2 132.83 91.64 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.481 0.181 . . . . 0.0 110.9 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -65.25 145.15 83.25 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.343 2.029 . . . . 0.0 112.567 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.06 142.97 5.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.226 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 0.7 OUTLIER -124.22 173.67 8.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.942 0.401 . . . . 0.0 111.28 -179.544 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -39.17 69.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.132 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.476 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 53.04 82.32 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.6 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.31 -51.31 0.25 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.532 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 62.45 -176.09 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 0.0 110.8 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.487 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -156.42 -75.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.64 144.73 14.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.596 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.41 -30.97 29.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.02 -25.9 63.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.223 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -55.99 -68.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.131 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' ' CZ ' ' A' ' 102' ' ' PHE . 3.1 tp10 -75.64 173.45 11.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.02 100.0 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.852 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tp -77.22 159.0 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.038 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.95 127.58 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 m -88.11 106.84 18.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.799 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.08 101.83 11.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.09 153.37 40.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.991 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -82.2 157.0 24.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -111.39 113.85 26.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.925 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.8 t -70.68 84.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -137.31 -74.77 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.955 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.97 -70.08 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.39 105.61 17.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.923 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.081 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.663 0.268 . . . . 0.0 110.897 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.78 164.51 35.37 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.443 2.095 . . . . 0.0 112.262 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 57.09 28.51 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.448 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -96.83 135.03 22.35 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -58.55 125.94 19.86 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.431 2.087 . . . . 0.0 111.994 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 136.14 33.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -58.24 164.17 2.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.904 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.452 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -89.48 114.63 26.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.37 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 128.05 -68.37 0.54 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.538 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 11.7 p -108.43 141.98 39.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.51 83.91 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.015 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 179.57 126.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.448 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 22.8 p80 -63.9 168.2 5.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.909 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -106.32 160.13 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.097 0.475 . . . . 0.0 110.818 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.21 35.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.292 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -99.24 -178.61 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.847 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -72.76 0.22 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -83.67 144.14 29.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.0 mm -145.44 146.91 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.993 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -108.63 106.81 17.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.412 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -91.05 134.73 34.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -167.6 164.28 14.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.88 37.46 24.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.08 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.61 28.79 17.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -166.03 176.14 7.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 21.8 p-80 -94.09 128.8 40.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.452 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 42.2 m95 -119.64 133.2 55.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.725 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 171.72 0.27 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 t -80.05 -39.76 29.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.3 pttt -90.95 -29.08 17.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.13 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -67.65 -30.76 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.953 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.43 75.8 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.888 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -120.73 136.82 54.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.841 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.26 135.3 57.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.4 m -80.1 -0.89 37.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.681 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 6.3 t0 -107.78 -63.02 1.36 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.716 0.293 . . . . 0.0 111.356 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 30.2 p -94.14 -21.09 19.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.456 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 59.11 39.76 22.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.9 0.381 . . . . 0.0 110.853 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 22.0 t -107.84 129.71 23.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.1 118.89 3.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.568 2.179 . . . . 0.0 112.479 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.5 mp -85.18 -75.39 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.75 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 57.38 31.82 20.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.238 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -156.45 -75.91 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.4 130.44 55.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.957 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.95 128.0 51.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.931 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CZ ' ' HG2' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -114.72 155.82 25.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.851 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.9 t -133.21 136.19 45.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.987 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -153.91 123.95 6.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.72 -60.58 4.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -176.54 -43.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 0.0 110.937 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 12.9 m -73.35 -170.77 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.0 p -113.03 122.91 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.06 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.418 ' CZ ' ' HB2' ' A' ' 92' ' ' ASP . 2.0 m-85 -119.26 155.79 31.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -102.39 149.24 24.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.706 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 2.5 mtmp? -54.57 -40.04 68.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.194 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -59.12 -29.53 67.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.923 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -84.12 -29.75 26.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.487 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 14.3 t80 -64.94 -30.22 71.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 3.5 m-85 -77.21 -41.22 42.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -81.35 -28.01 34.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 38.3 mmt180 -96.04 -55.47 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.22 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.43 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 12.4 m-85 -104.08 29.66 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.195 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.73 -151.14 5.7 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.278 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -103.01 153.49 20.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.8 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -144.85 -164.99 2.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.958 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 32.4 t -116.5 139.05 50.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.958 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -104.96 24.97 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.28 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.13 -53.13 1.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.976 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.21 -16.57 13.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.247 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 71.14 79.45 0.17 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.831 0.348 . . . . 0.0 111.01 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.4 OUTLIER -156.72 133.82 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.646 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.34 99.83 0.11 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.726 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.483 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 59.0 mt -62.49 141.54 96.62 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.548 0.214 . . . . 0.0 110.769 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.539 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 78.6 Cg_exo -42.83 168.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.736 2.291 . . . . 0.0 112.772 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -77.14 -55.64 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.926 2.417 . . . . 0.0 114.737 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.476 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 2.0 m -126.43 21.96 7.13 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -177.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.539 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 71.2 mm-40 -58.17 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.322 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -129.13 108.61 17.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.738 0.304 . . . . 0.0 111.112 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 13.4 p -143.49 157.68 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.74 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.48 134.96 39.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.064 0.459 . . . . 0.0 111.252 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.0 172.97 6.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.528 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -146.31 168.97 19.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.229 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.468 ' HG2' ' C ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER 40.73 -83.82 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.55 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' A' ' 138' ' ' ALA . 21.7 t0 -162.09 38.12 0.12 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.732 0.301 . . . . 0.0 111.19 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.43 157.17 39.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.698 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.67 153.18 11.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.668 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -143.47 147.54 34.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.023 0.44 . . . . 0.0 111.35 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 77.8 m80 -57.84 143.68 41.52 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.37 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -17.93 64.87 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 176.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -82.53 -41.06 20.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.222 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.41 -25.79 20.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.636 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.452 ' CE1' ' CD2' ' A' ' 171' ' ' LEU . 2.1 t80 -60.54 91.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.84 0.352 . . . . 0.0 110.657 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -167.78 174.25 7.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.12 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 49.5 t -76.23 150.25 37.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . 0.401 ' CG1' ' CG ' ' A' ' 170' ' ' ARG . 6.4 m -74.89 -35.56 36.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.345 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -88.75 -57.55 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.412 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.8 m -65.86 -28.09 68.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.157 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt 60.31 38.72 19.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.4 ttm-85 -128.96 145.14 51.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.028 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -78.29 155.94 29.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.028 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.457 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -106.46 168.72 8.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.675 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 166.94 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.315 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.5 m -43.37 122.04 2.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.539 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.73 -23.94 31.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.614 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -77.29 129.0 35.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.848 0.356 . . . . 0.0 110.88 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -87.98 121.65 30.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.941 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.448 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 17.8 p90 -131.07 179.04 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.435 ' CZ ' ' HB ' ' A' ' 7' ' ' VAL . 0.7 OUTLIER -132.63 114.91 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.525 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . 0.44 HD12 ' CG ' ' A' ' 139' ' ' GLN . 7.7 tt -93.73 110.81 22.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 0.0 110.51 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.19 159.95 33.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.76 -25.57 7.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.89 27.61 3.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.188 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 5.0 m 55.45 31.19 16.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.024 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 14.9 ttm180 -94.72 102.84 14.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.452 ' CD2' ' CE1' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -66.97 126.77 30.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.898 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . 0.415 HG13 ' CD1' ' A' ' 177' ' ' TYR . 8.6 p -145.34 140.73 22.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.711 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.9 155.09 23.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.775 0.321 . . . . 0.0 110.963 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.416 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 8.7 mtmt -60.51 -30.16 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.769 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.35 -59.07 5.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.272 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.39 -0.18 40.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.404 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.425 ' CZ ' ' HE2' ' A' ' 181' ' ' LYS . 8.7 t80 -61.67 -65.74 0.64 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.939 0.399 . . . . 0.0 110.657 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -57.21 -26.77 61.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.128 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 59.0 m -75.4 -22.84 57.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.339 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.19 12.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . 0.425 ' HE2' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER -171.93 -177.27 1.89 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.866 179.892 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.42 ' HE2' ' CZ ' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -129.42 -175.04 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.723 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -154.98 134.48 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.16 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.434 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.0 t -58.15 146.12 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.46 -169.35 12.6 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.482 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -60.35 146.19 84.78 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.565 0.221 . . . . 0.0 110.687 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -77.89 129.96 10.18 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.57 2.18 . . . . 0.0 112.238 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.75 154.61 35.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.441 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.459 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -138.73 173.72 11.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.143 0.497 . . . . 0.0 111.555 -179.631 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -50.57 32.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 59.46 96.1 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.76 -66.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.562 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 60.79 95.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' CE1' ' A' ' 115' ' ' PHE . 11.0 p90 -58.71 -32.6 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.67 129.88 2.71 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.491 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.01 -28.38 64.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.737 0.304 . . . . 0.0 111.124 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -64.48 -51.13 64.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.114 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.43 -36.44 71.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.076 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.432 ' HG3' ' CE2' ' A' ' 102' ' ' PHE . 31.3 mm-40 -72.74 176.03 5.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.83 100.0 4.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.808 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.4 144.03 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.95 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.8 pt -63.01 148.15 11.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -118.02 106.88 13.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -77.23 101.86 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.642 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.49 160.22 40.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.018 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -74.3 119.63 18.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -59.45 -28.41 66.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.011 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m 63.48 34.14 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -130.53 76.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -98.66 31.41 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.924 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -152.15 78.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.095 -179.991 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.757 0.313 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -51.58 164.68 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.524 2.149 . . . . 0.0 112.334 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 59.24 31.36 21.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.428 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.3 tp -109.97 134.91 20.55 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.94 125.91 18.29 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.422 2.081 . . . . 0.0 112.122 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.59 140.6 29.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.074 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.53 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 12.9 p -57.8 164.29 2.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -85.83 114.63 22.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.33 -73.03 0.38 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.613 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.53 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 14.2 p -100.26 153.63 19.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.822 0.344 . . . . 0.0 111.004 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.08 86.51 2.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.03 133.6 0.12 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.428 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.4 p80 -70.55 161.0 31.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.42 HD11 ' CD2' ' A' ' 84' ' ' HIS . 9.6 mm -94.5 153.67 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.401 ' CD2' ' ND1' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -161.13 29.99 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.925 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.12 170.27 7.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -74.18 0.33 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.673 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.94 91.7 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.661 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -104.95 140.79 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -89.87 106.9 18.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.584 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -90.77 115.02 27.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -156.5 156.78 34.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.275 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.69 36.34 16.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.056 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.18 29.9 17.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -168.21 -178.45 3.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 26.2 p-80 -100.11 125.29 46.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.443 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 37.0 m95 -114.34 132.82 56.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.826 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.64 172.2 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.12 -40.12 28.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -91.0 -29.78 17.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.22 -30.92 70.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.29 77.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -135.6 165.72 24.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.78 138.44 41.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.84 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -29.58 68.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.914 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -105.08 -59.79 1.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -61.43 -39.9 92.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 58.48 22.29 9.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.02 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.6 m -85.78 156.25 58.46 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.219 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -59.66 118.9 5.84 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.607 2.205 . . . . 0.0 112.159 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -112.96 54.89 0.71 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.712 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.76 30.21 3.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.138 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -141.48 -47.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.85 135.7 38.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.5 t -121.44 170.94 9.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.502 ' CZ ' ' CD2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -176.97 120.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.609 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t -131.72 157.72 43.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.876 0.37 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -170.22 124.0 0.72 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.887 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 -94.27 1.96 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.497 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -147.87 36.01 0.85 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.801 0.334 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.6 m -159.42 -176.88 6.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.3 116.19 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.129 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -110.47 166.87 10.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 22.6 p -90.83 168.07 11.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.685 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.4 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 0.1 OUTLIER -56.35 -44.92 80.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.962 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.421 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 12.2 t70 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -77.82 -21.0 52.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.35 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.502 ' CD2' ' CZ ' ' A' ' 102' ' ' PHE . 11.6 t80 -67.99 -44.08 77.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.368 . . . . 0.0 110.891 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 18.1 m-85 -60.67 -41.4 95.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -81.27 -30.43 34.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.351 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -80.96 -54.05 5.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.288 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -105.58 -43.09 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.104 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.53 164.71 11.28 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.487 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 85.8 m -60.72 155.08 19.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.774 0.321 . . . . 0.0 110.719 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -140.28 172.51 12.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.07 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.6 t -85.34 130.57 34.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.17 28.42 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.144 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.443 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.16 -53.76 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.78 -16.09 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.234 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.8 71.74 0.42 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.898 0.38 . . . . 0.0 110.81 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.417 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -128.09 -164.57 1.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -104.72 107.03 2.82 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.721 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.459 ' CG2' HD11 ' A' ' 15' ' ' LEU . 8.5 mt -87.89 127.35 58.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.4 0.143 . . . . 0.0 110.622 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.585 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 52.1 Cg_exo -53.14 177.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.241 1.96 . . . . 0.0 112.316 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.23 -49.16 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.082 2.522 . . . . 0.0 113.554 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.6 m -126.07 21.9 7.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.585 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -53.35 -175.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.328 . . . . 0.0 110.692 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -125.48 109.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 111.069 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.5 p -156.95 160.34 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.133 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.87 138.13 34.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.652 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.91 136.01 45.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.979 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.43 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . . . -74.83 96.65 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.38 -87.16 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.087 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -96.88 -48.17 5.55 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.823 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -84.4 163.01 19.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.644 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.9 p -108.62 151.31 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.708 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.443 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 13.7 m-85 -129.01 170.21 13.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.945 0.403 . . . . 0.0 111.299 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 37.7 m80 -97.56 140.19 32.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.955 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.07 -21.26 44.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -91.13 -38.66 12.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.306 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -98.73 12.45 35.48 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.449 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 53.5 t80 -101.56 101.63 12.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -158.94 177.76 10.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 45.2 t -86.48 150.18 24.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 27.6 m -72.17 -36.69 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.317 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -88.4 -56.94 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.498 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.6 m -65.87 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.159 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? 59.66 32.84 21.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.943 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -128.97 153.01 47.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.03 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -72.16 174.54 7.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.467 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -128.12 173.31 10.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.847 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 163.51 35.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.963 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.2 t -46.8 129.36 11.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.245 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 101.85 -25.31 28.38 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.464 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -70.45 129.18 38.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.821 0.343 . . . . 0.0 110.779 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.95 122.0 31.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.04 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.438 ' CE2' HD21 ' A' ' 171' ' ' LEU . 5.4 p90 -139.25 155.45 47.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.955 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.451 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 34.4 m-85 -103.02 171.08 7.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.612 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -130.3 114.46 15.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.4 mmt -70.73 -178.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.11 -28.71 60.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -97.58 28.96 3.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.057 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.07 43.63 24.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.021 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.72 124.09 45.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -74.66 120.83 20.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 p -145.3 127.39 9.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.1 m -72.34 -173.19 1.05 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.889 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.413 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 12.7 mttt -85.94 -32.24 21.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.84 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.42 -52.33 54.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.15 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -85.21 3.98 36.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.451 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.6 t80 -59.17 -66.05 0.57 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.964 0.411 . . . . 0.0 110.763 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.32 -27.89 57.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 85.9 m -77.83 -35.43 51.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.11 4.04 51.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.579 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.3 -177.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 110.862 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.914 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.0 p . . . . . 0 N--CA 1.457 -0.096 0 CA-C-O 120.851 0.358 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.07 -177.12 5.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.69 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -154.97 135.09 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.141 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG21 ' CE1' ' A' ' 163' ' ' PHE . 47.9 t -59.27 146.17 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.63 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.88 -169.11 11.98 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.482 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.4 mm-40 -56.3 135.5 75.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.549 0.214 . . . . 0.0 110.744 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 17.2 Cg_exo -64.54 135.62 46.54 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.382 2.054 . . . . 0.0 112.385 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -162.94 147.69 11.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.544 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.419 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 1.0 OUTLIER -117.77 173.35 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.109 0.48 . . . . 0.0 111.285 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -36.24 78.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.4 ' CA ' ' CG2' ' A' ' 132' ' ' THR . . . 57.66 74.88 0.29 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.09 -60.96 0.48 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.478 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 62.61 97.68 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.494 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -59.22 -166.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.899 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.43 147.44 19.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -84.03 -35.74 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.98 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -89.5 7.12 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.18 -31.22 34.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 33.4 tp10 -109.66 164.25 12.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -75.97 99.96 4.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.951 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tp -79.72 165.07 23.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.6 pt -62.89 164.16 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.5 m -126.82 107.07 9.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.774 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.99 101.78 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.547 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.09 151.26 36.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.952 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -82.04 156.97 24.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -115.7 144.44 43.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 p -96.85 40.02 1.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.53 -70.29 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 63.7 -79.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.007 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -69.82 -75.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.132 -179.974 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.742 0.306 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.45 169.0 18.09 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.534 2.156 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 58.41 29.09 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.834 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.422 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.2 tp -99.49 135.5 20.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -56.39 125.93 20.65 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.407 2.071 . . . . 0.0 112.047 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.12 137.94 31.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.442 ' SG ' ' SG ' ' A' ' 66' ' ' CYS . 15.3 p -58.37 164.22 2.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.881 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -87.25 114.63 24.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.27 -71.48 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.66 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.442 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 12.5 p -103.48 155.68 18.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.945 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.37 88.3 3.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.112 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -178.44 136.62 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.422 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.8 p80 -73.67 157.13 37.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.009 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.9 mm -88.77 151.55 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.92 37.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.019 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -103.36 179.91 4.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -39.8 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.713 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -109.21 110.22 21.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -120.0 154.79 22.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.389 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.53 107.06 15.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.093 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.7 119.0 30.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -153.01 162.71 41.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.148 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 57.01 36.32 27.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 62.54 30.38 17.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.009 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 21.0 mtt180 -164.2 -178.99 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.015 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 32.9 p-80 -98.8 121.24 40.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.022 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.449 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 46.1 m95 -112.48 130.46 55.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.39 171.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.881 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -79.93 -41.08 26.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.991 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -89.77 -28.61 19.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.016 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.83 -30.78 68.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.1 tp -72.14 80.39 0.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.057 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mmtt -144.63 141.12 29.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.914 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 11.6 t -59.8 132.45 54.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.1 m -77.85 -4.3 45.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.504 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -111.31 -31.8 6.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.065 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 14.1 m -111.87 -30.48 7.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 9.9 t-160 60.77 25.26 15.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.944 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.5 m -85.27 159.84 55.61 Favored Pre-proline 0 N--CA 1.453 -0.299 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.213 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -59.9 121.2 9.45 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.685 2.257 . . . . 0.0 112.312 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -124.55 30.48 5.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.698 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.49 61.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.555 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -92.04 -39.9 11.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.17 170.74 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.893 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.3 t -150.89 156.16 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.429 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.8 t80 -157.94 119.91 3.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.79 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.8 t -130.83 162.27 29.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 4.2 mmm-85 -153.63 124.04 7.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.77 -78.54 0.74 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -133.91 -74.29 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.778 0.323 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 m -59.8 164.66 3.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.3 p -107.3 115.93 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.65 120.89 39.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.799 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 27.3 p -60.09 170.51 1.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.429 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.11 -31.88 50.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.196 -179.739 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -50.82 -58.01 7.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.438 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.53 -20.97 58.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.494 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 9.5 t80 -60.14 -26.97 66.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.675 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -79.28 -44.3 21.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.956 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -85.29 -62.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.721 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.05 -50.77 72.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.78 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -88.29 -43.03 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.684 0.278 . . . . 0.0 111.362 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.76 -168.36 36.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.432 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 24.3 m -58.95 148.69 29.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -151.38 162.22 41.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.5 t -79.83 127.6 32.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.943 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.55 30.67 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.419 ' HB1' ' CD2' ' A' ' 143' ' ' TYR . . . -124.99 -56.39 1.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.058 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.74 -22.43 11.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.11 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 71.47 73.22 0.18 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.957 0.408 . . . . 0.0 110.912 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.424 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -128.53 -164.54 1.39 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.807 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -109.38 106.11 2.16 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.616 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.405 ' CG2' HD13 ' A' ' 15' ' ' LEU . 2.4 mt -94.97 128.02 40.75 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.448 0.166 . . . . 0.0 110.657 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.59 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.7 Cg_exo -52.25 175.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.196 1.931 . . . . 0.0 112.197 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.37 -47.3 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.646 2.23 . . . . 0.0 113.871 -179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.4 ' CG2' ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.53 21.91 7.73 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.177 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.59 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -56.73 -170.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.594 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.15 108.66 23.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.751 0.31 . . . . 0.0 110.544 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.2 p -157.19 161.72 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.71 135.06 39.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.246 179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 144.43 43.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.088 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -84.45 96.67 9.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.44 -89.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.529 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.1 m-20 -84.61 -44.5 13.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.749 -177.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.419 ' CE1' ' HB3' ' A' ' 169' ' ' SER . 7.2 m-85 -91.64 167.21 12.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.473 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.3 p -124.61 119.78 57.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.901 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.419 ' CD2' ' HB1' ' A' ' 124' ' ' ALA . 6.0 m-85 -102.98 138.7 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.424 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 64.4 m80 -60.82 141.27 57.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -18.79 60.23 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -88.24 -36.7 16.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.912 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.9 OUTLIER -100.89 21.27 13.94 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.447 -179.676 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.446 ' CE1' ' CD2' ' A' ' 171' ' ' LEU . 5.6 t80 -89.8 109.75 20.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.841 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.08 157.71 4.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.959 0.409 . . . . 0.0 111.259 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.16 150.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 10.8 m -91.09 22.47 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.508 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 39.2 t -136.74 -62.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.813 0.339 . . . . 0.0 110.618 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.9 p -85.02 -20.83 29.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.653 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 65.01 61.75 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.193 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -129.13 137.58 51.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.071 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -68.17 154.06 42.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.176 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.462 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.4 OUTLIER -122.68 147.1 46.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.64 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -127.54 165.89 19.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.0 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -46.05 128.2 9.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.206 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.17 -26.67 22.24 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.82 128.96 37.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.813 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -87.99 118.84 27.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.035 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.437 ' CE1' HG21 ' A' ' 10' ' ' VAL . 6.2 p90 -135.63 151.28 50.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 26.0 m-85 -97.06 171.01 8.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.795 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 2.8 tp -132.22 118.39 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.782 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.7 mmt -56.38 164.26 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -58.2 -30.46 66.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.159 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.92 -79.04 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.994 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 141' ' ' PHE . 36.5 p 178.99 77.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.804 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -144.5 119.38 9.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.446 ' CD2' ' CE1' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -66.92 121.43 15.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.841 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -139.09 140.76 37.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.001 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.31 160.99 14.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HG3' ' CE2' ' A' ' 164' ' ' TYR . 9.4 mttp -58.12 -46.84 84.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.136 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.35 -27.15 62.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.308 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -104.07 -6.87 20.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.447 ' CE2' ' CB ' ' A' ' 182' ' ' GLN . 8.3 t80 -56.2 -66.04 0.5 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.843 0.354 . . . . 0.0 110.986 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.6 -31.37 72.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.928 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -31.5 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.873 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -78.29 -52.02 9.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.13 -67.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.947 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . 0.447 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.922 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.429 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 14.2 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.784 0.326 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -140.95 179.18 6.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.716 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.3 p -155.11 133.81 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.445 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.1 t -54.8 146.31 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.662 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -143.23 -140.76 3.73 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.702 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.96 117.04 56.47 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.527 0.204 . . . . 0.0 110.865 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -65.03 137.51 52.87 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.388 2.059 . . . . 0.0 112.115 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.05 153.96 16.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.787 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 1.0 OUTLIER -124.86 173.47 8.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.109 0.481 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -28.42 68.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.692 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 55.35 61.05 7.82 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.527 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.65 -67.13 1.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.545 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 65.92 67.72 0.47 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.946 0.403 . . . . 0.0 110.739 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -75.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.03 153.8 30.59 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.06 -34.19 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -62.05 -31.17 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -68.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HB3' ' CD1' ' A' ' 102' ' ' PHE . 67.5 mm-40 -65.1 175.99 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 119.05 19.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tp -103.68 165.05 11.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.9 pt -62.88 146.89 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.168 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.6 m -113.62 106.86 15.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -77.61 101.83 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.59 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.05 166.06 26.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.961 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.43 157.03 23.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.1 -29.1 9.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.885 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.71 36.84 13.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.915 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -133.83 77.45 1.71 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.416 ' CZ ' ' HB2' ' A' ' 73' ' ' ARG . 47.1 m-85 -80.62 -74.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.87 86.43 4.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.061 -179.978 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.101 0 CA-C-O 120.655 0.264 . . . . 0.0 110.835 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.95 165.86 1.09 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.522 2.148 . . . . 0.0 112.173 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 58.3 30.56 19.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.833 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.421 HG23 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -107.45 135.22 19.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.991 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.27 125.9 17.37 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.359 2.04 . . . . 0.0 112.021 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.79 150.69 22.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 66' ' ' CYS . 7.7 t -58.52 140.51 53.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.711 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -62.1 114.85 3.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.71 28.77 45.62 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.98 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.402 ' CB ' ' HB3' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -135.65 -178.9 5.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.876 0.369 . . . . 0.0 110.849 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.6 -28.35 10.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.52 -167.58 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.421 ' CD2' HG23 ' A' ' 60' ' ' ILE . 6.2 p80 -107.54 171.76 7.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.971 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 10.4 mm -91.57 153.48 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.059 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -161.13 29.84 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.826 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -100.36 -178.9 3.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.926 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 36' ' ' PHE . 15.2 tpt180 -86.88 -70.11 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.986 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -81.35 105.66 12.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.111 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.12 153.8 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -104.79 111.95 24.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.797 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -90.95 139.03 31.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.982 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -176.7 150.59 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.119 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 58.64 37.26 25.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 62.09 30.35 17.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.111 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -166.33 167.97 15.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.895 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -92.45 117.96 30.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.449 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 69.3 m95 -105.73 125.13 50.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.67 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 175.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.955 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t -77.29 -42.08 38.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.898 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 ttpm? -91.14 -34.09 15.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 30.6 m -67.48 -28.2 67.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 48.7 tp -72.8 89.18 1.35 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.908 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.3 mttt -152.93 155.94 37.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -59.9 146.97 40.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 m -73.1 -30.98 64.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 -60.51 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.96 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 35.2 m -59.73 -34.25 72.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.962 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 57.77 22.25 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.097 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -85.18 156.33 60.13 Favored Pre-proline 0 N--CA 1.453 -0.284 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.071 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.38 118.97 6.0 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.471 2.114 . . . . 0.0 112.253 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.2 mp -111.43 60.8 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.85 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.68 36.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.081 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -153.42 -46.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.881 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 138.57 52.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.919 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -131.06 156.97 44.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.424 ' CD1' ' HB3' ' A' ' 25' ' ' GLU . 13.5 t80 -169.08 119.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.7 t -97.27 153.18 18.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.417 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -176.71 124.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.871 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.89 41.07 24.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 59.52 31.4 20.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.857 0.361 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.6 m -161.62 165.79 27.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.858 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.47 115.99 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.058 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -125.63 120.93 32.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.935 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.1 p -69.9 163.61 25.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -78.14 -24.96 47.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.353 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.426 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -55.56 -58.16 8.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 111.284 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -73.32 -20.75 60.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.254 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.424 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 32.9 t80 -61.98 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.426 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.7 m-85 -72.88 -44.79 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -79.89 -31.85 40.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.055 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -57.84 2.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.062 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.424 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 23.8 m-85 -99.04 31.13 3.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.973 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.14 169.06 32.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.404 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 86.2 m -59.78 153.56 20.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.765 0.317 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -154.9 170.66 21.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.03 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 18.8 t -81.22 137.96 35.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.82 14.03 16.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.51 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.09 -41.54 2.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.937 0.399 . . . . 0.0 111.064 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.8 m -105.9 -20.58 13.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.095 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 64.31 29.27 13.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.746 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tp -99.58 150.02 22.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.812 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.93 96.59 0.6 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.652 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.446 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 5.2 mt -59.86 140.32 90.02 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.478 0.18 . . . . 0.0 110.678 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.61 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.6 Cg_exo -48.24 175.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.301 2.001 . . . . 0.0 112.11 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.448 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.5 Cg_endo -77.38 -55.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.365 2.043 . . . . 0.0 113.948 -179.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.36 21.72 10.23 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.61 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.9 OUTLIER -60.07 139.07 57.71 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.649 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.4 t -74.89 108.71 6.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.826 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.0 p -151.78 161.07 3.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.12 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.81 141.86 29.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.859 0.361 . . . . 0.0 110.591 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.87 130.03 53.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.975 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.431 ' HB1' ' CD1' ' A' ' 143' ' ' TYR . . . -82.56 96.67 8.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.739 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 55.86 -86.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.451 0.644 . . . . 0.0 111.855 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -100.23 -48.41 4.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.954 -177.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -91.34 174.67 7.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.759 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 32.5 t -121.43 150.23 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.703 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.431 ' CD1' ' HB1' ' A' ' 138' ' ' ALA . 2.6 m-85 -131.34 138.99 49.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.417 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 70.1 m80 -55.12 144.93 22.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.3 -17.85 64.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.93 -38.34 14.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.078 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.417 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.8 p -95.48 25.21 4.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.531 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.447 ' CE1' ' CD1' ' A' ' 171' ' ' LEU . 0.9 OUTLIER -104.36 112.24 25.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.8 0.333 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.03 160.59 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.123 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -59.7 150.04 28.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 6.5 m -67.31 -27.31 38.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.343 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.54 -55.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.36 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 40.3 m -66.04 -28.0 68.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.078 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 55.21 36.78 27.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.997 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -109.8 137.79 47.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -64.02 154.42 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.0 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.458 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.4 mm? -113.79 163.85 14.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.703 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 170.92 15.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 4.4 m -44.69 123.03 3.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.501 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.92 -24.36 32.56 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.679 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -67.07 128.98 38.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.87 128.95 35.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.142 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.453 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 12.5 p90 -143.43 141.11 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.495 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 14.8 m-85 -97.96 171.07 8.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.796 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.5 tp -131.73 110.99 11.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.792 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 5.7 mmt -60.98 172.32 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -66.11 -30.22 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -98.21 29.18 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.44 84.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.974 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.49 129.54 13.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.447 ' CD1' ' CE1' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -73.74 126.11 29.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 11.3 p -145.06 135.75 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 29.6 p -80.29 167.23 20.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.875 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -57.54 -49.64 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.066 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.6 63.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -94.98 -15.45 23.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.261 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 7.7 t80 -55.58 -66.04 0.49 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.053 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.2 -29.5 70.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 4.3 m -72.81 -33.3 66.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.029 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.6 -30.88 15.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.201 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm 61.44 175.77 0.11 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.956 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.425 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 14.0 p . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.794 0.331 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.424 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -131.53 -175.62 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.7 p -155.03 139.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.263 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG21 ' CD1' ' A' ' 163' ' ' PHE . 39.8 t -66.55 146.09 13.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.665 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.01 -167.21 12.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.49 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 11.0 mt-10 -62.58 149.84 87.63 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.628 0.251 . . . . 0.0 110.832 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.1 Cg_endo -83.01 136.08 7.86 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.848 2.365 . . . . 0.0 112.399 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.06 142.89 5.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.301 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.423 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.9 OUTLIER -117.95 173.46 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.409 -179.639 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -44.21 92.46 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.005 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 60.13 102.45 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.436 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.12 -44.69 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.567 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 62.77 20.51 12.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.66 0.267 . . . . 0.0 110.978 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.496 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 55.54 -173.95 0.05 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.822 0.344 . . . . 0.0 111.047 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.57 152.32 16.84 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.1 -31.08 25.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.912 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -88.14 7.05 33.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.427 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.85 -67.97 0.42 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.9 tp10 -110.83 176.06 5.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.907 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 136.89 40.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mp -111.96 165.06 12.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.874 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.5 pt -62.94 135.19 27.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.122 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -99.24 106.87 19.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.741 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.64 101.83 11.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.471 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.47 163.03 35.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.986 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -86.59 150.9 23.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.931 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -98.31 -31.37 12.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.936 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 m 60.26 31.66 20.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.31 -73.09 0.49 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 73' ' ' ARG . 5.2 m-85 64.17 -78.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.983 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -74.94 111.49 10.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 179.967 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.112 0 CA-C-O 120.667 0.27 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.38 165.64 26.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.175 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 58.36 29.82 18.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.767 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.419 HG23 ' CD2' ' A' ' 69' ' ' HIS . 2.9 tp -103.02 135.66 19.36 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.88 125.92 19.01 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.408 2.072 . . . . 0.0 111.891 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.55 149.01 21.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.415 ' SG ' ' ND1' ' A' ' 84' ' ' HIS . 7.4 t -58.22 137.39 57.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.705 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . . . -61.06 114.76 3.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.266 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.47 28.38 39.91 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.914 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.54 -178.86 5.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.837 0.351 . . . . 0.0 110.96 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.9 -28.79 9.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.691 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.26 -165.94 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.703 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.419 ' CD2' HG23 ' A' ' 60' ' ' ILE . 7.4 p80 -110.76 154.56 23.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.418 HD12 ' CE1' ' A' ' 84' ' ' HIS . 5.7 mm -66.92 153.72 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.404 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.4 OUTLIER -168.83 33.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.783 -179.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -109.38 -178.97 3.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -95.13 -35.73 11.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -105.03 115.68 30.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.055 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.1 mm -133.62 153.88 37.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.229 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.9 mp -113.18 107.93 16.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.278 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -90.77 123.21 34.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.043 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.48 162.19 35.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.051 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 57.85 35.47 25.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.47 40.76 10.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.02 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.45 171.13 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -93.2 117.92 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.427 ' CZ2' ' HB2' ' A' ' 64' ' ' ALA . 73.5 m95 -109.72 125.41 52.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.791 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.418 ' CE1' HD12 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.26 176.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.957 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.01 -42.01 24.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.13 -15.56 29.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.113 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.5 m -96.74 26.16 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.734 0.302 . . . . 0.0 111.083 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.8 tp -124.06 29.55 6.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.998 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 152.21 20.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.16 147.03 52.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -66.56 -29.61 69.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.032 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -106.13 -58.38 1.92 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 17.0 m -59.92 -37.67 80.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 58.0 22.58 9.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.028 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -87.01 155.9 55.12 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.151 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.21 118.94 5.75 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.513 2.142 . . . . 0.0 112.339 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -101.81 70.69 1.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.89 35.19 1.75 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.108 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -152.42 -48.51 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.889 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -149.41 157.76 43.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.909 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 20.0 t -157.02 128.0 6.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.953 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.421 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.9 m-85 -98.45 171.96 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.59 140.43 17.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -153.64 124.0 7.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.818 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.34 -122.84 15.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.536 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -113.07 36.08 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 165.53 29.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.3 p -117.07 116.0 50.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.151 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.13 159.38 21.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.92 176.76 5.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.793 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.416 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.16 -29.44 48.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.332 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.79 -58.05 9.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -71.27 -20.89 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.293 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 5.9 t80 -65.67 -30.11 70.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 111.144 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 4.0 m-85 -79.08 -44.44 22.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.1 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -79.26 -41.8 27.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.212 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -83.02 -55.72 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.259 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -96.99 37.07 1.34 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.914 0.387 . . . . 0.0 111.139 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -156.45 -167.38 17.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.455 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -59.79 150.05 29.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.786 0.327 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -153.65 175.5 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 47.2 t -88.0 132.1 34.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.992 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.4 27.45 4.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.037 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.445 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -55.34 1.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.964 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 23.7 p -111.16 -17.44 13.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.169 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 66.45 73.68 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.873 0.368 . . . . 0.0 110.882 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.453 ' CB ' ' CE1' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -127.97 -163.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.731 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -111.34 97.0 0.92 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.734 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.7 mt -82.03 129.31 64.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.426 0.155 . . . . 0.0 110.63 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 77.5 Cg_exo -48.5 173.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.281 1.987 . . . . 0.0 112.337 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.48 -47.54 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.558 2.172 . . . . 0.0 113.892 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.2 m -126.22 21.85 7.29 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.612 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -56.18 -171.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.539 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.02 108.3 22.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.782 0.325 . . . . 0.0 110.554 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.403 ' O ' ' N ' ' A' ' 14' ' ' THR . 13.6 p -157.41 156.06 4.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.276 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.68 139.24 33.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.59 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.85 129.43 53.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.92 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.419 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.41 96.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.515 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.45 -88.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.857 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -88.8 -42.15 12.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.991 -1.004 . . . . 0.0 112.53 -177.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.4 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.2 m-85 -99.58 166.34 11.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.052 0.453 . . . . 0.0 112.12 -178.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.1 p -105.17 147.48 10.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.633 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.445 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 17.8 m-85 -132.62 142.59 49.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.881 0.372 . . . . 0.0 111.353 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 127' ' ' LEU . 66.4 m80 -70.4 145.08 51.33 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.02 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -17.74 64.66 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -88.48 -46.48 9.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.544 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.83 -33.73 22.83 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.454 ' CE1' ' CD2' ' A' ' 171' ' ' LEU . 36.8 t80 -56.99 99.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.88 0.371 . . . . 0.0 110.972 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.01 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.108 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 150.01 26.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.943 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 23.7 m -70.44 -30.56 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.154 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.8 t -106.99 -51.5 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.125 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 42.5 m -66.05 -28.14 68.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 24.0 mttp 54.84 39.62 31.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.03 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -127.84 141.83 51.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.907 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -61.93 166.2 4.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -122.44 172.21 8.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 164.61 31.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.07 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -47.16 128.82 12.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.317 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.08 21.79 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.35 128.91 38.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.631 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -90.48 117.34 29.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.13 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.425 ' CD1' HG21 ' A' ' 10' ' ' VAL . 6.0 p90 -133.75 168.27 19.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.848 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.502 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 61.4 m-85 -114.71 171.03 7.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.768 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.71 123.2 30.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 10.2 mmt -83.13 168.74 16.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.971 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -59.75 -28.49 67.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.012 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -97.35 28.16 3.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.1 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.38 38.53 28.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.43 141.73 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.454 ' CD2' ' CE1' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.31 125.08 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.967 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.3 p -145.11 130.24 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.46 -173.44 4.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.023 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -61.08 2.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.08 -23.56 47.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.366 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -89.98 -23.38 21.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.063 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.502 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.1 t80 -54.54 -66.03 0.47 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.839 0.352 . . . . 0.0 111.045 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -55.56 -26.18 42.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.119 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 72.4 m -82.02 -27.66 32.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.12 -20.69 18.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.387 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.72 -178.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 13.4 p . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.793 0.33 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.421 ' HE3' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.95 -177.95 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.595 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.2 p -155.1 131.84 2.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.276 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.446 HG22 ' CE1' ' A' ' 163' ' ' PHE . 52.9 t -55.41 146.16 4.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.09 -151.86 7.68 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.739 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -73.69 128.24 87.24 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.473 0.177 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -55.94 151.17 42.75 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.27 1.98 . . . . 0.0 112.342 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.04 149.75 7.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.36 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.449 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.0 OUTLIER -144.07 173.49 11.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.225 -179.471 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -52.94 63.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.767 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.4 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 59.18 83.24 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.457 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -167.15 -43.55 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.519 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 63.45 27.3 15.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 0.0 110.774 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.508 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 61.23 -170.19 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.839 -179.983 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.05 150.26 22.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.522 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -83.91 -42.69 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.866 0.365 . . . . 0.0 110.965 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.87 -29.15 68.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.29 -74.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.949 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.425 ' HG2' ' CG ' ' A' ' 102' ' ' PHE . 30.5 tp10 -72.92 163.44 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.958 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -76.0 99.94 4.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tp -77.38 163.25 26.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.7 pt -62.86 149.28 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.198 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 m -107.78 106.85 17.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.38 101.78 12.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.393 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.3 166.1 31.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.936 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -89.73 151.55 21.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -94.27 -178.57 4.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.855 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.8 m -133.29 35.65 3.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -97.49 -74.43 0.57 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 68.06 -69.64 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -105.7 83.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.885 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 -179.964 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 120.701 0.286 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.76 165.38 1.17 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.493 2.129 . . . . 0.0 112.195 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 58.64 30.66 20.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.412 HD11 ' CG ' ' A' ' 69' ' ' HIS . 8.3 tt -107.95 136.24 19.77 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.995 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.57 125.95 17.96 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.288 1.992 . . . . 0.0 111.98 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.6 157.72 15.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.177 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.409 ' SG ' ' ND1' ' A' ' 84' ' ' HIS . 4.9 t -58.26 142.49 47.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.455 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -62.9 114.75 3.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.27 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.72 28.53 46.55 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.997 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.43 -178.92 5.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.854 0.359 . . . . 0.0 110.944 -179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -109.19 -29.31 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.83 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -104.67 -165.67 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.847 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.412 ' CG ' HD11 ' A' ' 60' ' ' ILE . 3.7 p80 -106.6 173.42 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.986 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.402 HG12 ' HB2' ' A' ' 63' ' ' CYS . 8.3 mm -92.05 153.81 3.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.196 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.401 ' CD2' ' ND1' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -165.8 31.65 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.806 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.33 -178.96 3.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.23 -36.15 11.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.002 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -106.72 116.66 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.941 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.9 mm -134.41 154.02 36.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.284 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.81 108.95 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.291 179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.71 123.3 34.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.1 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.06 37.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.055 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.409 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 57.59 35.83 26.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.017 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 62.63 35.81 14.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.82 168.94 5.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 41.6 p-80 -94.21 117.95 30.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.925 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.455 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 56.2 m95 -110.08 127.23 54.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.709 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.409 ' ND1' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -51.9 175.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.116 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.05 -39.26 30.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.651 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -91.06 -34.67 15.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 9.3 m -71.43 -28.4 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -74.56 81.12 1.98 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.884 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -147.3 162.35 39.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.874 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.96 147.03 48.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -29.95 60.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.134 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.57 -63.01 1.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 19.4 m -59.31 -32.7 70.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.032 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 56.35 23.03 6.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.151 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -88.09 147.39 40.49 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.143 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.39 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.503 2.135 . . . . 0.0 112.286 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.4 mp -108.99 65.0 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.741 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.98 30.56 3.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.165 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -140.47 -49.64 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.21 167.37 22.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.819 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.0 t -157.0 127.96 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.984 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.481 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.5 OUTLIER -113.07 156.17 23.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.808 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.4 p -145.33 127.39 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.966 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -149.1 123.99 9.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -92.47 1.81 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.477 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -157.78 36.08 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.805 0.336 . . . . 0.0 110.838 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -154.82 152.16 29.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.876 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.15 115.99 27.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.064 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -118.84 158.13 26.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.2 p -99.93 171.7 7.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.691 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.04 -32.61 51.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.347 -179.724 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 3.7 t0 -51.53 -58.11 7.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.43 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -73.33 -20.68 60.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.328 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.508 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 8.5 t80 -62.32 -31.53 72.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.864 0.364 . . . . 0.0 110.815 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.3 m-85 -74.22 -35.26 63.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.755 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -85.09 -55.56 3.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.148 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -71.55 -48.26 49.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.348 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.42 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 5.4 m-85 -103.27 37.07 2.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.872 0.368 . . . . 0.0 111.087 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.74 173.13 35.07 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.06 155.03 14.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.717 0.294 . . . . 0.0 110.895 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.15 160.14 15.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.035 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -57.9 136.91 57.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.19 19.69 5.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.296 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.3 -48.29 1.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.827 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 1.8 m -111.02 -15.24 13.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.139 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 65.3 29.89 11.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.916 0.389 . . . . 0.0 110.627 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tp -82.62 136.08 34.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.765 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -55.69 99.96 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.731 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.1 mt -63.37 128.55 92.65 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.45 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 88.1 Cg_exo -44.22 169.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.547 2.165 . . . . 0.0 112.691 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.07 -47.03 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.622 2.214 . . . . 0.0 113.987 -178.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.4 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.11 21.41 8.09 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.45 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.0 OUTLIER -63.6 146.63 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -90.56 110.64 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 0.0 111.422 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.7 p -150.2 163.36 3.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.03 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . 0.413 ' HD2' ' CE2' ' A' ' 148' ' ' PHE . 0.0 OUTLIER -96.71 147.14 24.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.554 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.0 129.65 56.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.409 ' HB3' ' CD1' ' A' ' 143' ' ' TYR . . . -64.66 96.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.599 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 56.97 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.429 0.633 . . . . 0.0 111.686 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.0 m-20 -101.99 -48.75 4.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.776 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -82.06 160.6 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.725 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.4 p -106.23 153.46 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.58 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.409 ' CD1' ' HB3' ' A' ' 138' ' ' ALA . 33.0 m-85 -132.66 173.12 11.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.125 0.488 . . . . 0.0 111.389 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.82 163.15 27.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.904 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.8 -31.04 40.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.166 0.507 . . . . 0.0 109.741 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.25 -49.19 6.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.815 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 71.4 m -49.9 -38.04 34.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.318 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.44 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 0.5 OUTLIER -56.97 112.43 1.33 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 111.046 -179.692 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.06 171.73 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.95 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.77 149.98 37.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.93 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 9.9 m -75.55 -32.06 24.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.074 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.5 t -103.29 -49.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.13 -28.03 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 59.04 41.98 19.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.008 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -129.07 141.15 51.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.995 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -64.11 151.19 43.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.458 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.7 mm? -104.47 162.71 13.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.689 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.96 171.26 15.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.311 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 4.9 m -43.98 125.32 4.27 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.609 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.14 -22.49 38.23 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.769 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -68.55 131.3 45.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.772 0.32 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -87.88 128.45 35.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.008 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.449 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 8.3 p90 -145.03 140.56 28.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.127 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.501 ' CG ' ' CE1' ' A' ' 177' ' ' TYR . 54.1 m-85 -98.09 132.49 43.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.556 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.9 tp -87.96 111.0 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.839 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.5 mmt -74.77 148.76 40.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.901 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.72 -28.06 67.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.056 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -97.58 34.6 1.81 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 60.5 p 53.53 80.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.17 130.63 8.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.6 mp -92.5 128.77 38.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.958 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 6.6 p -144.99 118.84 2.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.2 p -66.56 -172.87 0.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.656 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -77.15 -39.26 49.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.355 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.11 -59.04 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.521 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -74.22 -9.33 58.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.501 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 8.6 t80 -57.05 -66.13 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -63.87 -28.59 69.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.009 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.0 m -77.77 -21.72 51.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.223 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.16 -29.85 13.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.774 0.321 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . 0.419 ' HE2' ' CD2' ' A' ' 177' ' ' TYR . 0.1 OUTLIER -170.35 -178.22 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 179.999 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.452 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 9.1 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.797 0.332 . . . . 0.0 111.489 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.426 ' HE1' ' CZ ' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -131.76 -163.06 1.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.427 ' HA ' ' HA ' ' A' ' 162' ' ' GLU . 9.8 p -147.58 132.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.442 HG21 ' CE1' ' A' ' 163' ' ' PHE . 21.6 t -55.58 146.19 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.224 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.33 -174.77 14.16 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.371 -0.919 . . . . 0.0 112.908 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 50.9 mt-10 -56.64 137.39 77.49 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.558 0.218 . . . . 0.0 110.935 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 14.7 Cg_exo -67.01 136.99 43.03 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.498 2.132 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.417 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.7 OUTLIER -166.07 142.97 5.22 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.113 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.547 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.6 OUTLIER -116.28 173.89 6.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 111.443 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -38.74 81.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.669 -179.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 71.67 55.72 7.22 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.336 -0.935 . . . . 0.0 111.975 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.04 23.24 30.28 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.804 -0.713 . . . . 0.0 113.042 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -51.07 95.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.868 0.366 . . . . 0.0 110.738 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 3.1 m-85 -57.79 -35.25 70.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.828 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.07 176.12 43.43 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.485 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.99 -30.79 25.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.844 0.354 . . . . 0.0 110.965 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.17 -31.83 73.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.66 -76.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.415 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 32.3 mm-40 -82.78 172.19 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.023 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -76.02 118.16 18.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tp -95.71 165.15 12.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.939 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.4 pt -62.68 144.21 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.178 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.2 m -109.19 106.76 16.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -82.74 101.64 11.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.263 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.1 166.04 28.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.155 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.03 145.45 44.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -95.02 -167.68 1.67 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.869 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.2 t -82.35 58.6 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 pm0 45.26 -169.41 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.569 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' HD12 ' A' ' 71' ' ' LEU . 4.4 t80 -91.9 -22.9 19.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.013 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -57.61 -20.52 33.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.189 0 CA-C-O 120.801 0.334 . . . . 0.0 111.479 -179.893 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.092 0 CA-C-O 120.686 0.279 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.35 154.61 40.99 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.526 2.15 . . . . 0.0 112.352 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 57.27 28.9 15.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.923 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.459 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -94.64 134.9 24.49 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.031 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.45 125.97 20.48 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.459 2.106 . . . . 0.0 111.981 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.01 146.8 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.148 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.9 t -57.1 155.29 8.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.421 ' HB1' ' CD2' ' A' ' 83' ' ' TRP . . . -80.08 114.71 19.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.565 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.38 -59.06 0.38 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.466 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.7 p -96.94 161.31 13.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -91.8 75.62 5.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -178.15 134.0 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.896 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.459 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 7.1 p80 -63.94 153.4 37.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.46 ' CD1' ' CE1' ' A' ' 84' ' ' HIS . 10.3 mm -79.24 151.26 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.406 HD12 ' CZ ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -157.35 30.61 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -102.99 -178.98 3.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -35.52 8.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.678 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -106.18 107.2 18.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.683 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.4 mm -128.92 153.06 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 111.485 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.1 mp -108.6 110.33 21.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.147 179.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -90.68 126.55 36.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.247 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.73 31.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.07 34.63 25.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.108 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.87 40.18 9.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.088 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -177.53 169.03 2.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.943 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 34.6 p-80 -88.8 120.97 30.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.896 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.421 ' CD2' ' HB1' ' A' ' 64' ' ' ALA . 55.2 m95 -111.7 128.24 56.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.85 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.46 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.83 167.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.854 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 t -73.3 -39.5 65.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.748 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -91.08 -37.42 13.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.19 -31.53 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.958 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.9 tp -65.97 85.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.945 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -156.1 161.38 40.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.922 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 147.04 40.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.1 m -69.41 -28.82 66.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.048 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.77 -60.19 1.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.9 m -58.69 -39.12 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.034 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 57.48 22.43 8.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 m -85.37 154.39 59.66 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.188 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.71 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.486 2.124 . . . . 0.0 112.204 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.3 mp -111.12 57.88 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.2 43.19 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -157.43 -62.23 0.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.99 128.97 41.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 11.0 t -129.89 127.91 41.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.033 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.415 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 4.2 m-85 -111.48 171.94 7.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.731 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -149.5 137.24 20.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 110.973 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -169.44 123.97 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.842 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.99 17.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.613 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 60.86 38.31 17.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.831 0.348 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -156.18 156.29 33.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.862 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.9 p -78.0 120.72 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.118 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -124.79 151.56 45.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.944 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 24.4 p -103.32 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.436 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.437 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.06 -41.01 36.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.291 -179.653 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -43.53 -58.04 2.82 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.59 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -75.58 -20.49 58.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 20' ' ' PHE . 56.0 t80 -64.32 -35.31 80.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.013 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 33.4 m-85 -67.63 -44.69 77.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.036 0.446 . . . . 0.0 110.87 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -80.49 -32.55 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.314 -179.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -80.82 -56.59 4.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.341 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.432 ' CG ' ' CE1' ' A' ' 114' ' ' PHE . 5.4 m-85 -95.48 -43.06 8.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.155 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -66.58 -150.64 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.3 m -103.18 154.05 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.68 0.276 . . . . 0.0 110.71 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 179.36 6.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 111.268 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . 0.41 ' N ' ' CD1' ' A' ' 129' ' ' ILE . 49.8 t -78.85 141.73 37.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.079 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.15 20.3 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.438 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -49.36 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.893 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 19.9 p -111.22 -17.66 13.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 67.35 47.09 1.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.956 0.408 . . . . 0.0 111.097 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.11 -162.08 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.58 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -117.33 79.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.903 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.41 ' CD1' ' N ' ' A' ' 122' ' ' CYS . 2.1 mp -59.53 139.09 89.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.497 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 73.9 Cg_exo -46.84 172.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.248 1.965 . . . . 0.0 111.989 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.426 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.3 Cg_endo -77.13 -55.02 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.305 2.003 . . . . 0.0 113.798 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.84 22.17 9.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.547 ' HG3' ' CD1' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.55 -166.85 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.521 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -122.77 111.68 31.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.967 0.413 . . . . 0.0 111.412 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 14' ' ' THR . 14.1 p -148.74 162.72 5.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.493 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.02 137.97 34.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.897 0.38 . . . . 0.0 110.891 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.65 173.09 6.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.748 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -142.21 134.4 27.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.931 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.505 ' HG2' ' C ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER 39.65 -84.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.609 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 138' ' ' ALA . 10.7 t0 -144.33 41.08 1.35 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.815 0.34 . . . . 0.0 111.152 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.432 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . 10.8 m-85 -148.11 165.05 32.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 14.6 p -115.51 121.11 66.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 141' ' ' PHE . 51.0 m-85 -113.61 140.1 48.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.283 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 3.3 m80 -58.87 150.4 24.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.802 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.74 -21.92 64.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.19 -49.14 6.54 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.598 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 63.9 m -57.04 -40.77 77.42 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.916 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.456 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 0.2 OUTLIER -56.85 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.119 -179.698 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.15 172.8 4.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.795 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.7 t -82.13 150.25 27.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.208 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 29.1 m -73.62 -31.89 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.304 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 20.5 t -99.46 -57.57 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.467 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.2 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.104 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? 60.0 44.5 13.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . 0.4 ' HB2' ' NH1' ' A' ' 155' ' ' ARG . 0.0 OUTLIER -128.95 139.63 52.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.079 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 148' ' ' PHE . 10.9 mp0 -66.58 166.31 13.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.428 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.2 mm? -122.22 166.42 14.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.396 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 169.16 19.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.029 0.442 . . . . 0.0 111.472 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 7.4 m -43.79 129.29 5.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.654 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 92.71 -21.36 39.37 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.882 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -73.91 130.96 40.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.835 0.35 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 14.4 mt-10 -87.99 127.07 35.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.019 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.447 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 25.9 p90 -134.62 179.07 6.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.419 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.524 ' CG ' ' CE1' ' A' ' 177' ' ' TYR . 16.1 m-85 -133.08 115.04 14.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.333 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . 0.428 HD13 ' CG ' ' A' ' 139' ' ' GLN . 5.9 tt -87.97 110.78 20.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 110.595 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 18.4 mmt -75.96 164.33 26.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.24 -28.13 62.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.171 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -97.38 28.92 3.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.54 33.96 23.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.987 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -98.39 98.55 9.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.456 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -66.97 133.11 49.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.788 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 2.7 p -145.18 140.26 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.0 m -71.46 -178.43 2.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.965 0.412 . . . . 0.0 111.313 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.11 -31.15 22.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.885 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.57 25.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.451 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -83.0 4.15 27.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.648 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.524 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 27.9 t80 -61.77 -66.14 0.58 Allowed 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.08 0.467 . . . . 0.0 110.966 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.03 -28.78 0.74 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.826 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -31.53 57.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.367 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.1 -31.74 12.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.514 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 64.42 174.28 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.868 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 13.2 p . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.869 0.366 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.434 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -145.08 179.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.605 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.7 p -155.03 135.38 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.358 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.425 HG22 ' CE1' ' A' ' 163' ' ' PHE . 43.9 t -60.42 146.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.45 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -130.14 -160.72 10.18 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.777 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 4.5 mm-40 -64.0 132.02 95.14 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.579 0.228 . . . . 0.0 110.832 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 21.9 Cg_exo -63.16 143.64 90.48 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.311 2.008 . . . . 0.0 112.337 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.13 155.01 11.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.372 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.515 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.1 OUTLIER -144.09 173.88 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.138 0.494 . . . . 0.0 111.697 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -68.38 0.24 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.144 -179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.49 63.32 1.57 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.268 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -109.45 -70.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.543 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 72.42 84.01 0.13 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.908 0.385 . . . . 0.0 110.793 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.483 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.4 OUTLIER -57.28 -167.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.926 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -177.51 179.69 48.08 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.581 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -81.32 -30.03 34.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 110.955 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -58.26 -26.26 62.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -56.99 -68.56 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.076 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.419 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 6.5 mm-40 -103.42 176.02 5.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.939 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 121.8 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.65 162.08 13.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.84 158.28 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 m -123.8 106.95 10.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.827 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.04 101.86 6.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.68 162.22 37.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.409 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 6.3 mp0 -81.61 156.99 24.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.892 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -107.5 171.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.2 t -97.89 37.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -127.02 163.09 24.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -169.76 -42.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -142.08 80.26 1.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.965 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.139 -179.993 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.682 0.277 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.99 168.73 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.546 2.164 . . . . 0.0 112.232 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 57.88 30.25 18.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.417 HD12 ' CG ' ' A' ' 69' ' ' HIS . 8.8 tt -105.01 136.65 19.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.975 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.71 125.88 20.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.351 2.034 . . . . 0.0 111.799 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.87 134.51 38.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.262 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.439 ' HB2' HG12 ' A' ' 70' ' ' ILE . 3.2 t -59.27 141.82 53.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.774 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.417 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . . . -63.38 114.84 4.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.132 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.91 26.37 45.57 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.025 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -128.67 -178.88 4.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.798 0.333 . . . . 0.0 110.832 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -134.99 35.61 3.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.951 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' CG ' ' CE1' ' A' ' 69' ' ' HIS . 16.2 tt0 -151.7 -88.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.446 ' CE1' ' CG ' ' A' ' 68' ' ' GLN . 1.5 p80 175.75 -179.18 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.758 0.313 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.439 HG12 ' HB2' ' A' ' 63' ' ' CYS . 3.2 mm -103.33 150.88 6.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.022 0.439 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.83 37.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.85 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -109.38 170.35 8.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.912 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -70.05 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.409 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -90.3 140.23 29.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.7 mm -141.56 151.24 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.16 106.96 17.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.496 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -90.83 115.48 27.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.978 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.71 167.03 30.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.115 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 mt 57.5 35.34 25.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.068 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 62.59 35.52 14.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.032 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -172.47 176.11 3.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.027 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.423 ' CD2' HG13 ' A' ' 70' ' ' ILE . 48.7 p-80 -95.43 117.95 31.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.417 ' CE2' ' HB2' ' A' ' 64' ' ' ALA . 61.5 m95 -110.72 125.79 53.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.731 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.93 175.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 t -80.01 -40.55 27.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.484 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -91.12 -19.71 22.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.27 17.65 9.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.306 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.93 73.59 1.47 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -127.26 150.49 49.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -60.48 126.42 27.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.799 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.4 m -58.48 -20.8 48.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.472 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -102.87 -63.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.765 0.317 . . . . 0.0 111.347 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.98 -30.18 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.25 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 15.0 t-160 57.87 22.35 8.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.028 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.9 m -87.23 152.21 52.45 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.177 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.93 118.97 5.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.24 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.3 mp -113.17 56.41 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.663 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.42 28.62 3.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.202 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -135.09 -46.54 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.781 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -148.75 138.02 21.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.804 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.5 t -112.96 156.02 23.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.436 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -158.14 120.72 3.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.4 t -112.93 152.96 28.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.75 123.95 8.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.56 -104.99 1.32 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.443 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -67.72 0.89 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.788 0.327 . . . . 0.0 110.825 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.7 m -70.08 -176.97 1.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.5 p -110.57 116.0 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.096 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -113.86 120.9 42.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -63.98 173.99 1.66 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.847 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.06 -30.0 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 22.6 t0 -53.33 -58.01 8.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.312 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -71.93 -20.72 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.079 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.483 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 8.6 t80 -62.04 -27.22 68.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 2.3 m-85 -79.15 -44.56 21.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt -85.41 -62.39 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.466 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -58.16 -52.09 67.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.762 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -88.46 -43.03 11.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.347 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.41 -159.9 17.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.416 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -103.09 142.92 33.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.786 0.327 . . . . 0.0 110.827 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 173.87 11.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.074 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.2 138.18 58.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.55 29.59 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.122 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.18 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.923 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 10.3 p -109.9 8.03 24.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.325 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 57.96 29.86 18.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.815 0.34 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.3 tp -87.55 143.82 27.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.787 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.65 103.69 1.24 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.698 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 53.8 mt -60.76 134.34 92.18 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.5 0.19 . . . . 0.0 110.489 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.489 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 80.4 Cg_exo -45.99 172.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.507 2.138 . . . . 0.0 112.54 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.72 -55.37 0.09 OUTLIER 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.856 2.37 . . . . 0.0 113.393 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -126.14 22.05 7.31 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.515 ' HG3' ' CD1' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -53.57 -178.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.492 179.836 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.52 111.96 33.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.908 0.385 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 7.1 p -157.09 164.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.952 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.59 138.18 34.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.493 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.72 130.08 52.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.785 -179.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.435 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.86 96.0 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 37.64 -88.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.1 m-20 -79.2 -34.27 43.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.789 -176.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.444 ' N ' ' CD1' ' A' ' 141' ' ' PHE . 1.3 m-85 -115.71 178.25 4.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 112.23 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 9.9 p -113.62 152.19 15.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.598 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -132.06 174.99 9.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.167 0.508 . . . . 0.0 111.561 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.48 166.63 20.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.19 -33.42 33.01 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.32 -49.31 6.42 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.891 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.53 -35.06 38.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.201 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' A' ' 156' ' ' GLN . 0.1 OUTLIER -56.92 117.97 4.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.221 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.34 -176.95 1.69 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.885 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.3 t -100.36 150.08 22.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.957 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 8.4 m -69.33 -27.47 34.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.4 t -104.99 -55.69 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.351 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.3 m -65.96 -27.92 68.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.979 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 17.9 tttt 58.04 31.94 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -123.97 144.18 49.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.015 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 148' ' ' PHE . 7.0 mt-30 -61.92 162.41 9.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.322 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.487 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.4 mm? -113.99 165.22 12.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.47 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.99 168.75 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.489 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 5.3 m -43.46 128.42 4.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.63 -25.35 23.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.681 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 129.69 40.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.784 0.326 . . . . 0.0 110.758 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.89 124.17 33.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.005 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.451 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 7.1 p90 -140.18 147.72 40.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.012 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.456 ' CG ' ' CD1' ' A' ' 177' ' ' TYR . 36.8 m-85 -102.16 159.72 15.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.86 110.94 21.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.757 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 13.0 mmt -74.63 166.25 23.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.029 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -60.62 -26.96 67.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -96.95 27.93 3.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.073 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 57.46 40.02 27.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.068 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -104.03 141.54 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -93.3 130.86 38.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.06 123.68 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 26.4 m -56.51 -170.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.95 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -74.4 -57.68 3.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.55 82.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.073 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -65.46 -25.7 67.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.957 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . 0.456 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 9.5 t80 -54.67 -66.13 0.46 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.01 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.78 -32.83 73.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 57.7 m -67.4 -31.56 71.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -80.55 -51.96 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.104 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.35 -67.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . 0.451 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 1.6 mt-30 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.935 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.426 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 11.9 p . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.833 0.349 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -154.49 -178.17 6.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.8 p -155.05 136.29 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.004 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.422 HG21 ' CE1' ' A' ' 163' ' ' PHE . 30.1 t -52.88 146.3 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.903 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -140.86 -144.14 4.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.817 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -76.59 120.14 80.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.552 0.215 . . . . 0.0 110.808 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -62.82 140.08 78.06 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.344 2.029 . . . . 0.0 112.127 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.36 164.55 34.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.462 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.5 OUTLIER -138.0 173.44 11.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -29.18 68.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.809 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 55.14 87.31 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.619 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.33 124.3 1.18 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.569 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -107.08 22.78 15.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.709 0.29 . . . . 0.0 110.865 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 63.3 -179.9 0.15 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.38 133.04 6.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.532 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -58.31 -30.53 66.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.836 0.35 . . . . 0.0 110.994 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -59.71 -28.64 67.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -58.52 -68.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 1.6 mm-40 -95.4 176.08 6.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.98 144.18 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.84 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tp -112.01 165.14 12.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.931 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.5 mm -62.79 157.54 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -124.75 106.95 10.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 101.88 12.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.546 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.71 149.62 43.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.945 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.21 145.31 37.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -108.91 -26.51 10.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.031 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 t 45.31 36.0 2.09 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -113.78 34.69 4.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.825 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -59.58 -69.21 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -69.85 78.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.15 179.945 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.644 0.259 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.35 164.59 30.03 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.459 2.106 . . . . 0.0 112.187 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.88 30.63 20.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.749 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.415 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.3 tp -104.76 135.3 19.32 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.067 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -58.0 125.93 20.08 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.412 2.075 . . . . 0.0 112.035 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.17 138.67 31.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -57.43 164.19 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.869 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.424 ' CB ' ' CE3' ' A' ' 83' ' ' TRP . . . -84.29 114.61 21.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.377 179.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.16 -82.1 0.35 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.482 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.0 p -91.34 154.2 19.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 110.94 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -75.8 88.86 2.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -178.53 135.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.415 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.1 p80 -72.23 145.28 48.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.01 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -72.27 153.35 7.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.16 36.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -112.07 138.14 49.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.815 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -55.15 -34.06 63.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.192 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.41 ' N ' ' HG2' ' A' ' 73' ' ' ARG . 2.0 m-85 -106.55 107.71 18.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.052 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.9 mm -123.5 153.44 29.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.078 0.466 . . . . 0.0 111.258 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -115.15 106.94 14.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.167 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 46.0 tttt -90.66 123.11 34.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.026 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.19 167.04 31.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.066 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.7 mt 57.29 34.12 24.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.125 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.84 34.3 14.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.79 171.98 5.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.058 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -89.72 117.94 28.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.852 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.424 ' CE3' ' CB ' ' A' ' 64' ' ' ALA . 47.4 m95 -111.44 126.08 54.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.848 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 1.0 OUTLIER -52.53 143.66 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.931 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.3 p -57.59 -37.58 73.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -91.08 -12.77 34.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.261 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 61.5 m -104.95 22.44 15.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.687 0.28 . . . . 0.0 111.152 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.2 tp -118.88 30.63 7.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.859 0.362 . . . . 0.0 110.864 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.6 153.27 20.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.871 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 5.4 t -59.33 147.02 37.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.74 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.77 -28.43 66.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.294 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -105.03 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 0.0 111.253 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -58.82 -29.44 66.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.166 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 57.77 21.8 7.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.134 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.8 m -90.46 156.61 45.44 Favored Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.166 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 118.94 5.77 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.443 2.095 . . . . 0.0 112.245 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.3 mp -101.29 72.27 1.42 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.898 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.5 30.6 3.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.084 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -146.6 -47.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.3 158.35 44.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.776 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 26.7 p -141.85 175.95 9.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.034 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' CE2' ' A' ' 114' ' ' PHE . 1.1 t80 -162.72 152.14 15.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.773 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -134.22 135.04 42.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.413 ' HG3' ' CZ ' ' A' ' 118' ' ' PHE . 28.5 mmt-85 -147.95 124.0 10.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.31 1.6 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -166.29 -44.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 110.872 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.05 179.84 1.41 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.929 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.4 p -108.25 123.0 63.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.008 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.42 169.53 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.866 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 21.0 p -121.85 168.21 12.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.634 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 8.6 mttp -78.14 -26.75 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -54.58 -49.77 69.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.265 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -83.94 -20.53 32.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 20' ' ' PHE . 9.0 t80 -61.41 -30.5 70.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.977 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.434 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.1 m-85 -69.19 -45.94 68.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.758 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -85.44 -60.77 1.93 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.594 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.27 -52.83 63.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.168 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.413 ' CZ ' ' HG3' ' A' ' 104' ' ' ARG . 5.0 m-85 -84.29 -43.06 15.19 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 115' ' ' PHE . . . -64.3 -136.96 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.514 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.5 m -103.06 153.97 19.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.732 0.301 . . . . 0.0 110.789 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.76 162.27 41.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.266 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.3 t -57.47 139.33 53.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.978 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.73 29.46 2.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.17 -58.15 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 15.1 p -107.67 10.37 29.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.358 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.22 36.24 27.12 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.783 0.325 . . . . 0.0 110.973 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 15.3 tp -99.73 137.4 38.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.939 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.99 131.74 36.52 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.658 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.427 ' CD1' ' CG1' ' A' ' 142' ' ' VAL . 12.0 mt -95.09 128.22 39.74 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.395 0.141 . . . . 0.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.596 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 82.4 Cg_exo -42.73 168.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.615 2.21 . . . . 0.0 112.614 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.426 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 23.2 Cg_exo -65.46 -55.36 0.46 Allowed 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.75 2.3 . . . . 0.0 113.843 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.52 21.49 7.8 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.596 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.1 pp0? -61.07 136.94 58.23 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.376 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.5 t -71.91 108.73 3.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.009 0.433 . . . . 0.0 111.054 -179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 11.0 p -144.83 159.33 14.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.906 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.79 136.22 37.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.03 164.31 12.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.033 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 143' ' ' TYR . . . -106.41 96.71 6.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.667 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 57.92 -86.24 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.361 0.6 . . . . 0.0 111.746 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.97 -49.18 4.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.789 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -84.25 161.26 20.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.597 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.427 ' CG1' ' CD1' ' A' ' 129' ' ' ILE . 7.2 p -103.89 152.21 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.553 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.412 ' CD1' ' HB3' ' A' ' 138' ' ' ALA . 19.5 m-85 -128.54 175.13 8.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.129 0.49 . . . . 0.0 111.654 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 163.4 21.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.041 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.23 -31.71 33.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.734 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -49.28 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.789 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 78.4 m -52.48 -32.35 39.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.991 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.418 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -57.05 119.82 6.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.034 -179.822 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.27 -177.04 1.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.975 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.9 t -101.47 150.09 23.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.03 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . 0.401 ' CG1' ' CG ' ' A' ' 170' ' ' ARG . 24.6 m -68.81 -26.87 33.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.335 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 27.3 t -107.03 -56.41 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.25 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.1 m -65.88 -28.13 68.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.101 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.11 34.9 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -126.42 142.34 51.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.969 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -58.38 152.79 16.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.262 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.482 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.3 mm? -109.5 107.96 18.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . 0.413 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -91.3 168.06 11.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.475 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.9 m -40.73 132.33 2.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.83 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.07 -26.99 16.32 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.618 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.8 128.92 38.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.331 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -87.99 114.5 24.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.452 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 11.5 p90 -128.16 143.62 51.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.015 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 11.1 m-85 -100.13 162.43 12.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.748 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -115.04 110.85 20.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.742 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.8 mmt -75.4 164.47 26.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.015 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -59.16 -26.26 64.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.129 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.71 27.09 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.099 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.0 46.76 18.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.922 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 0.1 OUTLIER -110.88 146.54 36.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -98.31 128.89 44.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.07 130.18 13.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 55.5 m -53.0 -179.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.108 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.411 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 0.5 OUTLIER -67.95 -61.03 2.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.32 72.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -63.58 -26.96 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.002 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -55.07 -66.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.007 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -53.99 -26.74 27.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.23 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.1 m -78.48 -30.16 47.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.976 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -93.74 -27.25 16.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.233 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm 63.28 173.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.885 -179.981 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 14.0 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.863 0.363 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' MET . . . . . 0.416 ' HE2' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.75 -175.09 3.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.636 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.2 p -154.39 150.8 11.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.156 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.433 HG21 ' CD1' ' A' ' 163' ' ' PHE . 38.4 t -67.39 146.25 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.706 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.66 -162.03 10.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.388 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -71.5 145.37 90.14 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.568 0.223 . . . . 0.0 110.63 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 4.5 Cg_endo -83.02 130.0 5.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.58 163.73 37.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.395 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 0.7 OUTLIER -144.08 173.78 11.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.173 0.511 . . . . 0.0 111.621 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.7 -38.27 87.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.428 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.445 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 64.24 81.54 0.11 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.65 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.72 -140.8 5.56 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.248 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 179.68 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.405 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 63.11 144.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.933 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 -160.45 8.9 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.534 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -83.98 -25.32 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.694 0.283 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -54.09 -26.64 28.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.245 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.43 -75.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.059 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 18.6 tp10 -101.79 163.5 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.867 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ptp85 -75.9 100.01 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.33 165.21 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.87 138.58 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.14 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 48.5 m -105.86 106.93 17.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.824 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -78.34 101.69 7.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.394 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.73 164.92 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.007 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.451 ' CG ' ' CE1' ' A' ' 74' ' ' PHE . 19.6 mt-10 -90.26 157.02 17.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -109.73 -29.41 8.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 22.5 m 62.18 31.41 17.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -115.86 71.71 0.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -105.39 31.29 5.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -158.53 79.78 0.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.927 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.733 0.302 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -51.71 165.82 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.463 2.109 . . . . 0.0 112.247 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.65 30.8 20.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.81 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.421 HG23 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -108.91 134.92 20.2 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -63.06 125.92 16.87 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.347 2.031 . . . . 0.0 112.163 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.75 147.36 26.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.2 t -59.01 154.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.905 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -82.86 114.81 21.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.575 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.7 -53.37 0.62 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.43 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 19.3 p -103.61 -178.99 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.767 0.318 . . . . 0.0 110.876 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.03 76.56 1.01 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.76 131.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.421 ' CD2' HG23 ' A' ' 60' ' ' ILE . 9.7 p80 -63.97 148.14 50.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.433 HD12 ' CE1' ' A' ' 84' ' ' HIS . 5.7 mm -77.08 153.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.01 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.406 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -172.64 35.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.832 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -104.88 179.11 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.86 -68.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.451 ' CE1' ' CG ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -80.99 115.96 20.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.9 mm -123.2 154.93 29.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.301 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.59 107.59 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.264 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -90.77 122.44 33.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.063 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.88 158.29 30.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.173 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 58.19 37.46 26.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.157 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 61.67 35.71 16.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.074 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -174.39 169.98 3.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.863 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.419 ' CD2' HG13 ' A' ' 70' ' ' ILE . 20.6 p-80 -89.33 125.31 35.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.961 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.422 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 58.6 m95 -113.65 125.36 54.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.433 ' CE1' HD12 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.71 171.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.063 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.05 -39.83 28.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -90.97 -28.26 18.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.988 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 79.1 m -71.96 -28.96 63.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.049 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.2 tp -79.59 82.83 5.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -137.63 150.59 47.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.4 t -64.25 130.06 42.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.789 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -23.49 52.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.491 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.13 -63.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.787 0.327 . . . . 0.0 111.226 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.0 m -66.54 -33.07 74.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.172 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.08 22.63 7.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.051 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.9 m -87.85 152.15 50.81 Favored Pre-proline 0 N--CA 1.453 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.227 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -57.24 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.504 2.136 . . . . 0.0 112.169 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.2 mp -108.86 64.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.746 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.97 29.42 3.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -135.11 -46.51 0.71 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.05 173.48 11.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.5 t -156.94 156.04 32.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.017 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PHE . . . . . 0.472 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -155.96 136.09 12.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.746 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 2.0 p -151.03 174.12 13.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.009 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -177.2 123.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.29 -95.55 1.86 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.535 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -142.19 38.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.906 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' SER . . . . . 0.417 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 0.7 OUTLIER -152.65 177.96 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.3 p -149.13 115.99 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.187 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.417 ' CZ ' ' HB2' ' A' ' 107' ' ' SER . 0.4 OUTLIER -122.15 159.89 26.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.2 p -71.53 160.22 33.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.656 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.411 ' HG2' ' CZ ' ' A' ' 115' ' ' PHE . 6.1 ttmt -56.94 -45.12 82.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.074 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.426 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 30.1 t70 -58.91 -29.5 67.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.107 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -84.1 -26.07 29.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.318 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 36.7 t80 -66.8 -39.06 87.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 112' ' ' ASP . 7.5 m-85 -65.38 -39.51 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.1 tttp -84.13 -30.12 26.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.119 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.9 mmm-85 -82.09 -53.79 5.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.192 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.25 -42.99 11.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.5 167.7 53.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.419 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 33.0 m -58.5 150.27 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.756 0.312 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -145.49 163.31 35.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.051 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.8 130.7 41.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.88 28.01 4.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.106 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.1 -54.62 1.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 26.8 p -111.08 -22.61 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 69.67 69.81 0.24 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.11 -166.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.792 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -103.5 86.95 0.55 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.557 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.406 ' CG2' HD12 ' A' ' 15' ' ' LEU . 16.3 mt -65.94 126.28 91.53 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.455 0.169 . . . . 0.0 110.833 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.567 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.4 Cg_exo -51.49 -178.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.233 1.955 . . . . 0.0 111.959 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 64.9 Cg_endo -77.24 -53.25 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.298 1.998 . . . . 0.0 113.901 -179.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.445 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.94 21.83 9.77 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLN . . . . . 0.567 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.0 OUTLIER -55.49 145.33 23.14 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.365 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -87.79 108.9 18.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.963 0.411 . . . . 0.0 110.862 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 11.4 p -150.5 159.82 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.078 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.71 137.55 35.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.83 130.67 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.975 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.416 ' HB1' ' CE1' ' A' ' 143' ' ' TYR . . . -70.71 96.65 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.748 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 55.31 -86.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.386 0.612 . . . . 0.0 111.797 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.414 ' OD2' ' CZ ' ' A' ' 141' ' ' PHE . 5.5 p-10 -99.6 -47.56 5.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.723 -178.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.414 ' CZ ' ' OD2' ' A' ' 140' ' ' ASP . 3.5 m-85 -79.26 163.24 25.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.95 133.05 61.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' TYR . . . . . 0.416 ' CE1' ' HB1' ' A' ' 138' ' ' ALA . 5.0 m-85 -111.06 171.45 7.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.05 0.452 . . . . 0.0 111.344 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 41.1 m80 -99.52 140.01 34.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.844 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.73 -20.07 45.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.01 -36.49 14.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.266 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 14.27 32.39 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.454 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 42.5 t80 -104.05 102.31 12.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.71 0.29 . . . . 0.0 110.657 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -156.86 -176.92 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.26 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -92.23 150.04 21.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 16.8 m -65.59 -26.7 39.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.315 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -104.43 -56.28 5.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.345 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 20.3 m -65.91 -28.12 68.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.074 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 30.0 7.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.13 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -119.14 153.05 35.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.24 154.08 42.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . 0.455 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -115.9 137.46 52.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -109.34 161.28 15.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.039 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.7 t -46.23 130.28 10.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.372 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 109.34 -34.36 5.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.591 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.17 130.29 42.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.722 0.296 . . . . 0.0 110.784 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -87.96 119.65 28.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.961 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' PHE . . . . . 0.433 ' CD1' HG21 ' A' ' 10' ' ' VAL . 5.7 p90 -134.01 147.57 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' TYR . . . . . 0.43 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 30.9 m-85 -100.59 147.3 26.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.673 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.41 114.19 28.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.5 mmt -69.39 174.49 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -66.81 -29.08 68.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.028 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -97.74 29.8 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.028 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.86 33.95 23.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.949 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -88.57 132.73 34.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' LEU . . . . . 0.454 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -84.94 121.01 27.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.02 121.56 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.124 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 56.1 m -54.88 -174.37 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.856 0.36 . . . . 0.0 111.084 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -69.44 -60.94 2.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.15 -38.96 84.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.021 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -59.25 -24.77 63.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -54.77 -63.72 1.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -49.18 -27.9 3.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.304 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 -25.33 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.95 -20.55 20.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.518 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.48 -177.58 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.836 0.351 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.736 0.303 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.2 t -104.45 84.52 2.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.31 113.79 27.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.2 m -60.1 150.16 71.77 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -167.77 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.467 2.111 . . . . 0.0 112.328 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -64.8 80.15 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.895 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.427 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 13.5 p -124.2 158.75 30.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.154 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.425 ' HE3' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -139.74 -179.96 6.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.682 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.5 p -155.06 137.0 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.115 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG23 ' CE1' ' A' ' 163' ' ' PHE . 48.1 t -57.88 146.14 8.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.565 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.62 -151.11 6.44 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.782 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -71.8 122.57 87.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.446 0.165 . . . . 0.0 110.954 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -64.44 142.92 80.62 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.328 2.019 . . . . 0.0 112.149 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.04 158.43 14.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.435 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.8 OUTLIER -129.2 173.31 10.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.155 0.502 . . . . 0.0 111.267 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -37.84 81.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.932 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 57.01 79.62 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.552 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -145.55 -55.35 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 64.19 29.48 13.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.729 0.299 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 58.93 -168.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.973 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -148.99 125.3 2.0 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -59.9 -31.53 69.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.51 -30.23 70.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.46 -74.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 5.7 tp10 -78.2 151.35 33.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.977 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -76.08 101.96 5.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.875 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.92 165.13 25.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.86 137.61 24.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -104.34 106.89 17.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 101.77 11.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.469 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.4 157.31 44.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.001 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.08 116.88 18.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.6 163.71 23.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.5 t -107.4 31.57 5.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -104.1 37.63 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -98.69 31.49 2.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.911 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -167.31 33.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.844 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -129.37 137.53 51.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.145 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 59.95 -179.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.163 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -88.1 79.61 7.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.892 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.3 -63.05 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.514 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.5 140.4 11.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.65 146.42 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.855 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 60.55 158.33 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -100.79 85.21 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.875 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.43 -169.35 26.77 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.492 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.86 99.43 0.66 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.494 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 t 60.59 110.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.821 0.343 . . . . 0.0 110.858 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.5 -46.62 1.22 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.9 -103.0 2.52 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.553 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -96.59 114.35 25.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.918 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 6.4 mtp -106.07 -178.66 3.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.97 117.84 1.23 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.505 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -158.82 102.19 1.66 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.854 0.359 . . . . 0.0 110.93 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -98.67 -142.01 12.88 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.439 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.03 148.64 42.7 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.459 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.0 84.95 58.97 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.684 0.278 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.74 167.15 23.8 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.468 2.112 . . . . 0.0 112.211 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 57.9 30.01 18.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.762 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.424 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -104.5 135.38 19.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.046 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.69 125.89 18.4 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.412 2.074 . . . . 0.0 112.069 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.48 148.76 21.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.109 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.36 138.11 56.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.735 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -61.6 114.85 3.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.269 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.92 28.29 42.5 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.069 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.12 -178.92 5.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.883 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -106.73 -28.93 9.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.76 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -166.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.821 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.424 ' CD2' HG21 ' A' ' 60' ' ' ILE . 5.1 p80 -107.53 161.51 14.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.02 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.435 HD12 ' CE1' ' A' ' 84' ' ' HIS . 6.9 mm -74.83 153.66 6.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.053 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -163.46 30.84 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -107.2 -178.99 3.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -84.46 -74.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -75.74 125.59 29.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.6 mm -134.27 148.2 29.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.123 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.3 mp -105.38 106.97 17.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.465 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -90.93 114.98 27.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -148.94 163.47 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.115 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.41 HD13 ' CZ2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER 55.45 35.59 25.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.07 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 62.36 40.75 10.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -176.99 166.5 2.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.013 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -88.88 117.97 28.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.458 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 65.1 m95 -111.77 126.0 54.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.844 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.435 ' CE1' HD12 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -51.57 175.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.171 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -80.03 -40.69 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.283 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -91.08 -16.48 27.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.128 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -96.4 26.1 4.58 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.7 tp -128.62 29.24 5.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.996 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.38 150.26 21.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 4.3 t -60.46 125.25 22.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.816 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.29 -22.51 61.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.289 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -99.69 -63.08 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.735 0.302 . . . . 0.0 111.206 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 32.0 m -66.76 -32.31 73.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.169 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 59.07 23.35 11.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.102 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.1 m -90.82 149.34 40.17 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.153 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.82 118.95 5.8 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.561 2.174 . . . . 0.0 112.248 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.9 mp -111.04 63.05 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.733 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.78 39.49 1.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.188 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -148.25 -49.18 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -136.52 174.2 10.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.8 t -156.98 156.15 32.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.925 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.504 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.7 OUTLIER -150.13 154.63 38.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 60.1 p -132.29 144.76 50.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.993 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.64 139.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.6 40.11 95.96 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.569 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 59.6 31.22 20.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -148.99 145.15 27.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.1 p -87.22 115.97 28.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.127 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.68 170.52 8.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.826 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.5 p -99.56 169.04 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.83 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 4.5 tttp -78.13 -29.79 49.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.267 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -53.42 -58.02 8.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.469 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.5 p30 -74.16 -20.94 60.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.314 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 13.5 t80 -63.65 -30.95 71.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.75 0.31 . . . . 0.0 110.926 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 5.1 m-85 -79.12 -39.21 34.21 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -85.07 -64.04 1.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.335 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -64.79 -48.62 73.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.64 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -102.01 36.89 1.98 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.332 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.94 -146.61 4.44 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.594 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.0 m -94.79 152.35 18.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 110.977 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.45 170.37 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.5 t -64.11 141.34 58.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.74 27.14 3.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.121 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.24 -58.08 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.9 p -108.27 5.4 25.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.414 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 59.38 29.47 19.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.14 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.85 151.95 25.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.742 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -81.13 107.79 2.75 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.698 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.435 ' CG2' HD11 ' A' ' 15' ' ' LEU . 12.1 mt -70.41 130.92 88.7 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 110.52 -0.178 . . . . 0.0 110.52 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.609 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.5 Cg_exo -47.52 175.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.361 2.041 . . . . 0.0 112.23 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.7 Cg_endo -77.2 -49.91 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.471 2.114 . . . . 0.0 113.799 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.06 21.7 7.41 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.609 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -57.0 -168.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.68 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -123.59 108.9 21.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.936 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.4 p -152.67 158.87 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.065 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.86 135.92 38.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.793 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.93 135.0 47.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.975 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.429 ' HB1' ' CD1' ' A' ' 143' ' ' TYR . . . -74.31 96.57 2.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.939 0.399 . . . . 0.0 110.618 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 55.75 -86.33 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.4 -48.19 4.88 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.873 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -83.95 162.58 20.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.715 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.3 150.9 7.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.429 ' CD1' ' HB1' ' A' ' 138' ' ' ALA . 23.0 m-85 -133.26 175.08 9.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.452 . . . . 0.0 111.37 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -82.31 161.84 22.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.046 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.6 mp -81.08 -30.2 34.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.149 0.5 . . . . 0.0 109.678 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -91.2 -49.26 6.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.665 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 74.7 m -53.87 -31.26 49.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.9 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.432 ' CZ ' HD23 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.91 121.1 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.091 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.24 -177.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -100.92 150.14 23.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 16.7 m -64.73 -26.87 41.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.263 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.2 t -109.53 -55.9 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.338 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 m -65.86 -28.11 68.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.012 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 30.87 17.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.986 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -119.02 139.97 50.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.951 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -58.11 154.29 13.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.26 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.482 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.7 OUTLIER -116.57 107.32 14.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.538 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -90.17 172.28 8.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 7.9 m -43.01 132.29 4.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.734 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.35 -27.86 13.97 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.664 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -67.0 128.84 37.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.802 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -88.04 122.21 31.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.449 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 8.2 p90 -138.45 146.75 42.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.427 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 48.1 m-85 -101.58 151.47 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.2 tp -107.65 110.96 22.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.797 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.5 mtp -69.4 161.23 29.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -62.7 -28.57 70.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.074 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -97.76 29.11 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.019 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.14 83.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.978 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -154.92 131.66 10.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.4 mp -83.62 128.21 34.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.4 p -145.11 122.45 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.082 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 20.4 m -58.38 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -75.52 -57.05 4.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.84 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -33.6 70.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.108 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -72.98 -28.91 62.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -56.84 -66.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.946 0.403 . . . . 0.0 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.31 -49.73 75.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.942 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 67.5 m -59.43 -26.3 65.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.964 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -79.08 -51.98 8.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.252 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.74 -66.57 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.098 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.203 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.798 0.332 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -87.86 156.46 19.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.15 110.22 1.54 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.856 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 m -148.2 149.0 31.07 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.94 -45.8 0.88 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.529 2.153 . . . . 0.0 112.346 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -170.07 90.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.437 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p -117.61 158.57 18.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.152 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.42 ' HE2' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -139.45 -173.64 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.595 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.3 p -151.82 147.69 15.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.424 HG23 ' CD1' ' A' ' 163' ' ' PHE . 43.9 t -66.95 146.23 13.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.628 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.32 -157.9 9.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.572 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 0.0 OUTLIER -76.31 151.29 83.35 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.665 0.269 . . . . 0.0 110.815 -179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 2.6 Cg_endo -83.0 143.47 11.54 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.874 2.383 . . . . 0.0 112.417 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.57 142.92 8.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.344 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.7 mt -127.04 173.54 9.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 111.293 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -50.49 41.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.793 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.405 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 62.69 80.82 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.457 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -160.27 -48.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.368 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 59.56 46.33 12.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 110.923 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE1' ' CD1' ' A' ' 115' ' ' PHE . 14.0 p90 -59.17 -179.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.929 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -173.54 -132.41 1.53 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.567 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -55.21 -28.42 52.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.736 0.303 . . . . 0.0 111.16 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.35 -25.99 60.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.201 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.89 -70.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.073 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.429 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.3 tp10 -101.62 175.11 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 100.68 4.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tp -63.15 165.11 7.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.3 pt -62.9 148.49 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.5 m -107.74 106.78 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.82 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.19 101.82 9.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.435 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -146.86 154.02 40.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -78.63 157.05 28.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -110.6 102.31 10.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 41.3 p -60.18 86.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -150.32 -76.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 57.68 28.58 16.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.025 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -176.67 78.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.902 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.28 42.34 3.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 63.19 124.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.143 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.83 35.78 19.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -95.8 -83.54 1.65 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.479 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 tp -52.34 -44.97 44.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.834 0.35 . . . . 0.0 111.515 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -107.73 142.5 37.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -83.41 164.65 19.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -71.67 151.4 43.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -161.35 93.44 0.12 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.491 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.37 -38.16 3.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.528 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -174.59 -41.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.15 -36.51 1.91 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -81.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.492 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -170.35 35.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.807 0.337 . . . . 0.0 110.883 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.3 mtt -96.02 161.05 14.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.66 160.55 8.95 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.5 p -69.02 -74.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.859 0.361 . . . . 0.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.13 42.29 0.26 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.47 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.31 -160.65 54.09 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.572 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.49 140.9 31.98 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.617 0.246 . . . . 0.0 110.88 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.43 163.96 36.34 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.49 2.127 . . . . 0.0 112.226 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 56.98 29.07 15.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.447 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -99.1 134.89 21.02 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.077 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -58.46 125.96 19.95 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.458 2.105 . . . . 0.0 112.097 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.19 140.12 29.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.057 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.3 p -58.36 164.22 2.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.93 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . . . -87.98 114.59 24.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.445 179.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 125.09 -66.46 0.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.56 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -109.83 155.34 21.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.858 0.361 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -75.39 87.53 2.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.143 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.47 134.44 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.447 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 11.5 p80 -72.77 141.05 48.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.45 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.6 mm -67.52 153.65 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -172.55 35.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.864 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.82 145.83 38.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.179 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.0 110.84 18.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.853 0.359 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.0 mm -121.67 153.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.211 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.8 mp -109.61 106.75 16.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.305 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -91.03 116.36 28.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.964 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -157.13 165.63 35.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.163 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 mt 59.09 36.43 24.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.072 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 62.3 34.42 15.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.023 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -176.45 178.57 1.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.917 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.406 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 22.1 p-80 -94.41 126.85 39.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.422 ' CZ2' ' HB2' ' A' ' 64' ' ' ALA . 36.7 m95 -116.86 132.73 56.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.45 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.08 171.55 0.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.07 -40.21 28.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.089 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 pttp -90.95 -28.18 18.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.127 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.413 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 57.7 m -67.6 -30.62 70.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tp -81.12 94.12 6.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.979 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -155.35 154.53 32.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.933 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 147.03 38.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.7 t -72.78 -31.27 64.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.916 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -97.28 -59.97 1.68 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.977 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 45.7 m -60.02 -34.47 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 57.37 22.46 7.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.056 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -84.63 156.65 61.74 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.048 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.9 118.9 5.94 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.522 2.148 . . . . 0.0 112.246 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.4 mp -103.24 71.03 1.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -106.07 30.91 5.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -148.55 -49.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.412 ' CD ' ' N ' ' A' ' 100' ' ' ARG . 0.0 OUTLIER -142.99 128.99 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.5 t -123.83 171.09 9.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.462 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 1.6 m-85 -156.32 151.5 26.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -151.65 140.05 20.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -150.01 123.97 9.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.23 -88.64 1.59 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.506 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.02 35.86 0.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.421 ' HB2' ' CE1' ' A' ' 109' ' ' TYR . 48.9 m -150.73 -175.02 4.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.7 p -136.97 116.0 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.082 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 107' ' ' SER . 1.3 m-85 -116.69 173.24 6.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.9 p -89.13 178.31 6.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.42 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 12.3 ttmt -73.65 -48.97 28.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.91 -30.55 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.218 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -84.04 -21.64 31.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.319 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 12.9 t80 -69.52 -41.17 76.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 6.6 m-85 -66.78 -36.8 83.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.921 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.36 -44.4 13.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.25 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -78.94 -50.92 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.244 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -108.67 37.02 2.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.59 165.25 33.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.444 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.6 m -57.85 151.08 18.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.757 0.313 . . . . 0.0 110.842 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -163.3 159.43 22.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.167 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.3 t -74.2 135.76 42.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.787 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.66 34.21 1.9 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.12 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.096 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.5 p -109.9 12.54 23.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.411 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.7 mp0 55.5 30.84 15.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.754 0.311 . . . . 0.0 111.04 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -103.49 130.49 50.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.96 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.98 131.19 51.93 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.444 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.442 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 51.9 mt -79.25 140.06 56.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.922 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.562 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 92.7 Cg_exo -44.83 171.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.833 2.355 . . . . 0.0 112.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -77.37 -55.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.588 2.192 . . . . 0.0 114.807 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.405 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 1.6 m -126.55 21.46 7.13 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.562 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 82.9 mm-40 -61.42 -176.04 0.07 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.65 116.49 49.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.973 0.416 . . . . 0.0 111.167 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.8 p -157.06 162.96 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.523 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.473 ' NE ' ' CZ ' ' A' ' 148' ' ' PHE . 0.0 OUTLIER -96.22 142.17 28.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.016 0.436 . . . . 0.0 110.857 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.416 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.6 OUTLIER -116.05 123.64 48.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.836 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.405 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -57.43 96.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.077 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.98 -87.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.223 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 138' ' ' ALA . 6.5 t0 -96.64 -47.13 6.03 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.988 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.88 157.31 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.083 0.468 . . . . 0.0 111.746 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.416 ' HA ' ' CB ' ' A' ' 137' ' ' ARG . 7.6 p -107.68 149.51 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.621 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -131.92 163.24 28.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.008 0.432 . . . . 0.0 111.403 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.59 165.38 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.964 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.2 mp -81.03 -32.76 33.99 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -91.34 -49.26 6.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.903 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 80.8 m -50.44 -38.93 46.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.321 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.473 ' CZ ' ' NE ' ' A' ' 136' ' ' ARG . 2.5 t80 -56.91 118.38 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.233 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.09 179.24 2.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.048 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -85.33 150.09 25.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.971 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 8.2 m -72.17 -34.64 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.5 t -102.95 -51.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.159 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 14.0 m -66.02 -28.05 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.982 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm 57.79 40.71 25.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.132 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -128.96 143.16 50.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.972 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -61.35 172.36 1.15 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.954 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.436 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.8 mm? -127.45 164.62 21.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 158.91 43.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.4 t -43.01 129.46 4.44 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.619 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.75 -27.95 16.85 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.553 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -70.27 129.13 38.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.772 0.32 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -89.31 114.92 26.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.972 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.456 ' CE2' HD23 ' A' ' 171' ' ' LEU . 7.2 p90 -129.64 152.05 49.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 23.0 m-85 -101.48 139.31 37.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.739 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.94 127.09 46.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.707 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.4 mmt -90.66 161.92 15.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.039 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -23.6 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -96.05 27.45 3.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.093 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.06 30.09 15.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.099 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 154.52 19.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.862 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.456 HD23 ' CE2' ' A' ' 163' ' ' PHE . 0.4 OUTLIER -109.25 121.73 45.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.024 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.08 121.67 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.002 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 21.7 p -76.07 -169.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -43.39 54.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.283 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.05 -52.25 61.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.6 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -84.98 4.06 35.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.64 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.0 t80 -67.53 -66.11 0.6 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.881 0.372 . . . . 0.0 110.83 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.13 -23.53 65.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 75.2 m -84.64 -32.75 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.046 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -89.91 -29.66 18.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.284 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 61.79 175.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.7 p . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.792 0.33 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -130.44 126.25 36.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -153.27 82.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 m -106.96 82.69 1.14 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.16 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.59 -45.64 1.09 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.574 2.182 . . . . 0.0 112.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -159.3 38.86 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.5 p -72.85 158.43 6.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.12 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.442 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.11 178.73 6.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.663 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.4 p -154.96 135.39 4.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.248 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG21 ' CE1' ' A' ' 163' ' ' PHE . 61.4 t -53.54 146.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.592 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -139.35 -148.63 5.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.657 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -72.98 115.28 38.74 Favored Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 122.906 -0.173 . . . . 0.0 110.73 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -62.3 135.41 53.91 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.251 1.967 . . . . 0.0 112.213 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.23 167.9 27.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.42 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 1.4 mt -143.99 173.91 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.226 0.536 . . . . 0.0 111.746 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.96 -35.99 71.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.501 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.408 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 56.99 94.78 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.589 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.43 103.33 0.31 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.298 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 16.5 mt-10 -50.91 -71.71 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 111.069 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -176.94 -66.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.91 120.97 1.41 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.489 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.95 -44.22 14.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -29.69 68.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.79 -31.34 68.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.962 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 6.6 tp10 -109.23 160.68 15.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.933 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.29 101.92 5.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.901 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.89 164.95 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.85 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.8 pt -62.95 147.88 11.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.22 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -114.88 106.91 14.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.757 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.77 101.83 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.626 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.65 146.86 31.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.947 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -75.4 147.75 39.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -104.87 160.14 15.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.6 t -98.7 32.56 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -105.63 78.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -94.23 -33.32 13.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.912 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -131.86 82.23 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.66 82.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.079 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 63.09 18.09 10.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.506 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -173.77 -64.67 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.879 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 64.3 -81.01 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.508 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.62 119.15 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.315 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.63 -42.14 22.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.816 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.24 90.04 7.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.94 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -103.99 116.85 32.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.953 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.88 -146.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.549 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.42 62.41 0.49 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.518 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 m -99.39 152.8 19.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 0.0 110.86 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 165.95 -141.63 7.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.56 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 151.84 -84.92 0.15 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.458 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 45.3 m-70 -104.39 -49.48 3.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.1 ttt -164.91 114.84 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.924 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.93 148.01 42.35 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.5 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.41 131.98 40.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.912 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -176.09 122.62 0.87 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.526 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 136.44 95.89 0.44 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.471 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.7 85.2 2.26 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.665 0.269 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.12 164.57 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.542 2.161 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 59.5 30.81 20.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.925 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.433 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.6 tp -103.81 134.75 19.56 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.034 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -58.72 125.93 19.73 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.415 2.077 . . . . 0.0 112.056 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.33 138.51 31.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.13 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.8 p -57.98 164.27 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -87.86 114.66 24.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.501 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.59 -71.1 0.45 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.527 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 13.6 p -103.59 153.07 21.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.826 0.346 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -74.03 87.04 1.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -179.05 137.74 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.433 ' CG ' HG12 ' A' ' 60' ' ' ILE . 12.3 p80 -76.53 145.8 38.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.446 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -73.53 153.76 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.94 35.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.961 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -110.59 159.61 17.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -60.11 -75.25 0.06 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -74.86 112.12 10.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.3 mm -120.93 152.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.226 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.9 mp -111.79 106.78 15.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -90.81 128.01 36.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -161.48 158.95 27.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.261 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.404 ' CD1' ' NE1' ' A' ' 83' ' ' TRP . 0.6 OUTLIER 59.57 38.45 22.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.09 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 61.43 29.32 18.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -173.9 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.866 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.409 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 23.4 p-80 -105.34 124.31 49.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.453 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 49.3 m95 -112.37 130.77 55.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.714 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.446 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.14 171.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.1 -39.98 28.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.003 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -91.03 -29.79 17.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 74.6 m -67.13 -30.73 70.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.957 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.6 tp -69.5 90.61 0.55 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -148.42 148.27 30.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.846 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.8 t -58.13 147.04 31.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 t -74.75 -29.1 61.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.252 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.847 0.356 . . . . 0.0 111.16 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 15.9 m -61.7 -32.57 72.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 54.15 24.73 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.129 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -83.9 146.7 49.67 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.138 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.63 118.99 5.69 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.533 2.155 . . . . 0.0 112.268 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -114.32 108.66 17.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.88 30.99 2.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.174 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -139.78 -47.08 0.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.43 174.21 10.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -157.0 127.98 6.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.948 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.418 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 50.2 t80 -129.93 120.64 25.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 93.2 p -138.0 156.1 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.5 mtt85 -154.03 124.43 7.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.931 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.18 -54.15 4.22 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.532 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -176.33 -42.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.331 . . . . 0.0 110.88 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -78.73 151.29 32.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.832 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 13.0 p -114.12 122.75 68.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.049 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -145.54 133.08 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 17.9 p -55.59 148.38 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.427 ' HB3' ' CE1' ' A' ' 115' ' ' PHE . 1.8 mtmp? -64.09 -19.98 65.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.421 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 t0 -46.62 -58.07 4.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.818 0.342 . . . . 0.0 111.323 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -77.68 -20.62 53.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.075 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.505 ' CZ ' ' CD2' ' A' ' 118' ' ' PHE . 11.1 t80 -58.16 -27.89 64.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.899 0.381 . . . . 0.0 110.695 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.427 ' CE1' ' HB3' ' A' ' 111' ' ' LYS . 1.9 m-85 -73.04 -28.77 62.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -82.31 -31.8 29.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.503 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.437 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 9.1 ptp180 -88.57 -37.25 15.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.443 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.505 ' CD2' ' CZ ' ' A' ' 114' ' ' PHE . 93.9 m-85 -103.36 -43.11 5.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.888 0.375 . . . . 0.0 111.151 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -70.31 170.83 44.37 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.468 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 71.5 m -58.65 152.36 18.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 110.805 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -138.65 172.33 13.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.037 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.1 t -85.27 129.61 34.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.958 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.51 30.62 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.034 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.454 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.08 -56.17 1.56 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.7 p -107.83 -20.12 13.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.162 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 68.63 70.74 0.29 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.84 0.353 . . . . 0.0 110.868 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 tp -130.28 -165.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.842 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -105.48 99.35 1.56 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.678 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.427 ' CG2' HD12 ' A' ' 15' ' ' LEU . 16.1 mt -75.73 125.59 88.23 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.47 0.176 . . . . 0.0 110.719 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.583 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.8 Cg_exo -51.62 -180.0 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.141 1.894 . . . . 0.0 111.96 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 74.4 Cg_endo -77.32 -49.39 0.1 Allowed 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.398 2.065 . . . . 0.0 113.818 -179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.408 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.8 21.72 7.58 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.583 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.0 OUTLIER -55.71 146.47 21.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.277 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.87 108.92 19.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.998 0.427 . . . . 0.0 111.028 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.0 p -153.25 159.33 3.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.105 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.77 137.64 35.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.666 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.01 150.86 24.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.425 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . . . -92.43 96.49 10.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.178 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.413 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -93.57 -46.88 7.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.843 -177.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -87.27 166.92 14.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.679 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 7.3 p -119.82 127.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.785 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.454 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 4.3 m-85 -110.06 134.78 51.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.989 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.421 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 71.1 m80 -59.52 138.95 57.53 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.853 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.43 -19.64 57.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -85.06 -37.88 19.8 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.9 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.7 p -98.16 12.88 33.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.451 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 3.4 t80 -86.14 121.92 29.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.735 0.302 . . . . 0.0 110.832 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.98 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.122 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 150.08 24.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 4.7 m -66.08 -30.32 49.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.114 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 27.9 t -111.81 -52.2 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.108 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 15.3 m -65.99 -28.05 68.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt 57.66 32.58 22.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.998 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -111.93 133.96 53.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -62.3 157.91 18.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.124 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.477 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.3 OUTLIER -126.74 125.41 41.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -104.05 177.73 4.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.409 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.1 m -45.61 129.31 8.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.668 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.88 -27.09 15.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.792 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.58 128.97 39.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.76 0.314 . . . . 0.0 110.793 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -87.91 129.61 35.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.039 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.442 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 10.9 p90 -150.75 154.13 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.006 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -106.46 171.02 7.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.47 111.03 12.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.827 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.91 -178.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.947 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -27.52 33.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -97.5 29.68 3.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.076 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.48 83.63 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -150.37 147.12 27.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.451 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.99 121.03 32.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 9.4 p -145.09 126.39 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.949 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.1 p -78.07 -175.39 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.818 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -78.57 -26.94 45.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.13 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.94 78.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.35 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -103.92 -4.51 23.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.673 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -56.99 -66.19 0.49 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.75 -27.2 64.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.873 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 -39.75 61.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.12 4.05 51.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.599 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.04 -177.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.957 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.86 0.362 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -74.0 -73.94 0.21 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -107.48 146.59 31.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.8 m -122.06 83.09 44.34 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.111 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.52 -61.63 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.568 2.178 . . . . 0.0 112.291 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -155.49 85.7 1.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.935 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.406 ' CG2' ' CE1' ' A' ' 164' ' ' TYR . 11.0 p -126.0 158.83 35.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -112.45 -176.94 3.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.643 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -155.14 136.53 5.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.345 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.3 t -61.38 145.54 12.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.649 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.14 -171.07 13.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.429 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.6 mt-10 -61.03 149.19 82.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.0 Cg_endo -78.27 138.79 16.21 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.593 2.195 . . . . 0.0 112.373 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -164.11 142.91 7.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.265 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.414 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 1.0 OUTLIER -119.82 173.54 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.129 0.49 . . . . 0.0 111.455 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -36.13 82.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.801 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 57.53 98.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.544 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.33 -76.95 0.12 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.568 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 61.05 77.37 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.785 0.326 . . . . 0.0 110.837 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.513 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 11.1 p90 -59.43 -39.51 83.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 65.17 179.77 8.05 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.638 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -57.63 -21.98 42.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.692 0.282 . . . . 0.0 111.195 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -54.45 -27.62 38.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -77.91 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.943 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 53.6 tp10 -92.75 156.28 17.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.991 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -76.02 100.05 4.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.22 160.15 22.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.6 pt -63.0 141.29 18.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.105 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.9 m -115.96 106.97 14.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.752 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -78.47 101.91 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.794 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -141.94 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.965 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -69.22 156.96 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -100.78 -170.07 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -98.83 -33.29 10.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.64 173.13 1.8 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.411 ' CE2' ' HD3' ' A' ' 73' ' ' ARG . 0.7 OUTLIER -176.24 -43.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -128.49 31.55 4.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.911 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.32 -31.23 63.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -162.62 108.84 1.22 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.056 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.67 -175.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.919 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.27 -63.52 0.3 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.476 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.68 125.06 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 0.0 111.423 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 60.4 178.63 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.74 84.55 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -82.97 125.17 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.868 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.69 140.76 5.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.503 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.22 -50.68 1.07 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.558 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.2 t -99.88 140.38 34.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.337 . . . . 0.0 110.854 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.98 135.7 8.44 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.536 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -171.41 114.1 0.52 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.451 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -93.22 138.85 31.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.78 0.324 . . . . 0.0 110.956 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.2 ttp -85.23 -56.83 3.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -60.5 -94.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.553 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.78 -68.55 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 59.53 165.12 0.14 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.503 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 157.1 -162.33 31.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.506 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.11 89.52 2.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.653 0.263 . . . . 0.0 110.933 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.73 161.86 41.92 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.528 2.152 . . . . 0.0 112.191 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 59.73 31.18 20.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.452 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -104.72 134.73 19.51 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.046 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.8 125.94 18.46 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.405 2.07 . . . . 0.0 112.102 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.71 140.44 32.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 p -57.59 164.2 2.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.0 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.423 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -85.12 114.67 22.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.569 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.13 -72.82 0.38 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.558 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.3 p -100.72 154.04 18.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.785 0.326 . . . . 0.0 110.962 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -76.03 86.22 2.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.158 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.04 127.63 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.452 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 10.1 p80 -63.97 161.84 15.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.933 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.406 HD11 ' CD2' ' A' ' 84' ' ' HIS . 8.8 mm -94.5 153.09 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.968 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.4 ' CD2' ' ND1' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -162.12 30.34 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.921 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -103.67 176.16 5.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.934 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.411 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -83.06 -78.32 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.708 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.26 97.37 0.93 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.755 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -104.9 141.34 20.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -89.81 106.98 18.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.621 179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -90.9 115.53 28.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -157.02 158.93 37.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.261 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.33 36.77 23.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.077 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.18 30.22 17.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -168.22 178.77 4.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 27.3 p-80 -96.56 125.05 40.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.423 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 36.8 m95 -113.72 133.21 55.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.772 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.406 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.69 173.1 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -79.99 -40.65 27.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -90.97 -30.71 16.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -67.3 -31.03 71.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.983 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 22.8 tp -71.7 81.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -138.55 164.11 30.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.14 146.89 43.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.925 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.17 -27.41 68.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.059 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -111.73 -57.77 2.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.038 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -59.25 -45.17 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.068 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 61.09 23.25 13.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.1 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.0 m -86.57 157.77 55.05 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.14 118.96 5.93 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.482 2.121 . . . . 0.0 112.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.1 mp -110.05 35.95 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.659 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.54 -17.82 63.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.559 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -91.35 -55.34 3.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.755 0.312 . . . . 0.0 110.987 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -142.6 160.97 39.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.8 t -157.06 127.95 6.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -105.89 160.63 15.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -139.75 157.62 45.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.414 ' HG3' ' CE2' ' A' ' 109' ' ' TYR . 2.8 mmp_? -141.31 172.06 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.818 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.78 68.48 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.566 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -90.08 -71.1 0.63 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.784 0.326 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.06 -173.23 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.972 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.5 p -99.5 123.33 52.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.16 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.414 ' CE2' ' HG3' ' A' ' 104' ' ' ARG . 1.1 m-85 -121.49 161.57 22.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 15.1 p -82.92 168.38 17.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.713 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 1.0 OUTLIER -57.9 -35.99 71.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.022 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.424 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 4.4 t70 -76.33 -23.6 54.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.194 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.6 -21.06 49.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.407 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.513 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 11.6 t80 -67.64 -44.89 76.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.813 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.497 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 17.3 m-85 -59.6 -42.89 93.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.871 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.71 -28.01 40.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.5 mmt-85 -78.08 -54.97 5.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.217 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -110.88 -43.06 3.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.168 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.15 168.88 3.89 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.636 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 84.8 m -65.3 153.26 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.741 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.24 162.1 37.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.1 t -77.94 128.67 34.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.96 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.34 30.67 3.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.44 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.04 -49.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 30.9 p -116.57 -0.92 12.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.421 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 62.6 69.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.922 0.391 . . . . 0.0 110.928 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.1 mp -146.83 143.0 28.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.778 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.4 104.34 1.84 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.702 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.402 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 1.7 mp -72.07 138.23 82.0 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.507 0.194 . . . . 0.0 110.708 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.57 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 94.6 Cg_exo -43.08 171.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.746 2.297 . . . . 0.0 112.844 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.39 -55.2 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.835 2.357 . . . . 0.0 113.828 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.95 21.46 7.52 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.57 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.5 OUTLIER -63.43 139.11 58.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.484 179.768 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.4 t -73.44 108.76 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.039 0.447 . . . . 0.0 111.007 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.416 ' O ' ' N ' ' A' ' 14' ' ' THR . 10.7 p -146.11 160.47 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.85 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.32 134.85 38.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.438 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -114.13 130.57 56.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.923 -179.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.431 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -66.59 96.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.72 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 46.76 -88.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.491 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 138' ' ' ALA . 19.4 p-10 -89.24 -43.89 10.66 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.879 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CD2' ' OD1' ' A' ' 140' ' ' ASP . 5.8 m-85 -89.32 164.14 15.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.989 0.423 . . . . 0.0 111.682 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.438 ' HA ' ' CB ' ' A' ' 137' ' ' ARG . 9.3 p -114.04 149.33 16.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.71 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.44 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 13.7 m-85 -132.3 174.91 9.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.383 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 47.2 m80 -98.22 144.21 27.9 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.879 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.01 -17.92 62.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.25 -47.95 7.2 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.798 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -84.4 -31.61 24.6 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.676 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.445 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 31.7 t80 -56.84 110.19 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.351 . . . . 0.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -161.17 -176.97 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.074 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.5 150.03 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.019 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.73 -29.42 47.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.1 t -110.9 -51.6 6.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.184 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 38.4 m -65.94 -28.09 68.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm 53.15 30.6 10.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -111.1 140.03 45.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -61.78 156.17 21.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.901 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.459 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -117.88 168.11 10.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.844 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.1 168.85 19.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.022 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.6 t -47.96 126.69 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.26 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.47 -25.27 27.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.736 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.63 128.82 37.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.698 0.285 . . . . 0.0 110.656 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -91.38 119.07 31.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.19 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.447 ' CE1' HG22 ' A' ' 10' ' ' VAL . 3.4 p90 -138.71 164.6 29.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.837 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.467 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 76.8 m-85 -112.63 156.84 22.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.862 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 tp -116.19 113.33 22.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.7 mmt -58.13 177.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -58.28 -49.02 78.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.993 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -74.3 -78.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 40.7 p -177.24 37.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.796 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -93.3 144.93 24.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.445 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -94.59 120.96 35.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 10.0 p -139.73 130.58 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.068 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.6 p -86.13 -172.4 4.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.42 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 1.1 mptp? -63.75 -57.76 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.032 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.38 -29.44 48.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.297 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -90.04 -23.46 21.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.467 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.3 t80 -56.12 -66.12 0.48 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.953 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.26 -44.91 94.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 65.9 m -61.26 -31.5 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -76.07 -51.35 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.69 -67.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . 0.422 ' HB3' ' CE2' ' A' ' 177' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.875 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.856 0.36 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.96 114.43 28.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 67.73 -69.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.998 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.8 m -157.66 149.36 17.11 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.098 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.51 -45.55 1.15 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.526 2.151 . . . . 0.0 112.375 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.56 82.3 0.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.1 p -95.8 158.63 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.067 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.456 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.62 -176.94 6.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.558 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -150.77 150.61 13.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.352 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' CD1' ' A' ' 163' ' ' PHE . 24.3 t -66.92 146.42 13.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.831 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.7 -179.65 16.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.385 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -57.4 139.39 80.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.475 0.179 . . . . 0.0 110.678 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 16.3 Cg_exo -65.84 140.49 61.38 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.364 2.043 . . . . 0.0 112.493 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -166.14 142.94 5.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.257 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 0.9 OUTLIER -114.89 173.26 6.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.079 0.466 . . . . 0.0 111.333 -179.553 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -34.35 77.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.788 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.401 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 58.18 65.23 3.66 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.417 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -153.6 82.22 0.17 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.622 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -84.2 5.05 27.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.547 0.213 . . . . 0.0 111.225 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 2.9 m-85 69.89 -67.04 0.25 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.36 133.88 3.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.597 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.02 -30.39 26.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.904 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.88 -31.15 71.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.52 -75.09 0.05 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.41 ' HG2' ' CD1' ' A' ' 102' ' ' PHE . 9.1 tp10 -60.06 165.37 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.878 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -75.91 99.95 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.719 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tp -86.0 165.0 17.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.012 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.4 pt -62.96 149.92 9.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.9 m -122.59 106.88 11.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.796 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -80.62 101.76 9.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.505 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -146.17 166.04 27.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.036 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -81.26 157.04 25.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.96 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -102.78 174.47 5.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 p -103.0 35.92 2.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -128.4 161.73 28.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -166.25 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -150.61 80.22 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.79 -68.97 0.8 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.12 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.14 117.13 7.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 60.61 31.49 20.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.39 -102.99 0.52 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.7 tp -54.65 128.88 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.805 0.336 . . . . 0.0 111.424 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 60.55 158.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.94 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.97 141.53 33.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.897 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.27 -32.77 69.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.84 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.7 -148.18 21.65 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.544 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.09 71.33 0.26 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.555 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.4 m -95.01 114.16 25.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.308 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.61 86.64 0.83 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 140.61 -159.15 26.31 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.491 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 60.57 33.13 20.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.842 0.353 . . . . 0.0 110.88 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.0 ttp 60.41 80.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.878 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -95.55 -28.54 9.53 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.499 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 162.72 5.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.89 -138.64 14.28 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.516 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 136.14 179.82 17.06 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.528 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.34 83.0 1.05 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.909 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.03 168.98 19.03 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.527 2.151 . . . . 0.0 112.156 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 57.85 29.88 18.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.866 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 3.1 tp -98.69 135.18 21.12 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.056 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -60.35 125.87 18.58 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.35 2.034 . . . . 0.0 111.964 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -102.71 151.14 22.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.153 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.44 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 4.5 t -58.16 137.73 56.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.787 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HB3' ' CZ2' ' A' ' 83' ' ' TRP . . . -62.5 114.65 3.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.172 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.05 25.68 39.81 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.11 -178.9 4.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.931 0.396 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -112.76 -30.74 6.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.182 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.95 -168.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.063 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.404 ' ND1' ' CD2' ' A' ' 71' ' ' LEU . 2.1 p80 -102.36 172.42 6.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.419 ' CD1' ' CE1' ' A' ' 84' ' ' HIS . 12.8 mm -98.06 154.13 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.297 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.414 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -167.02 32.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.68 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -99.17 -179.06 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.894 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.25 -67.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.55 133.65 33.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.067 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.9 mm -138.89 151.42 23.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.111 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 76' ' ' LEU . 6.2 mp -105.05 106.95 17.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.528 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -90.96 115.02 27.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.4 43.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.071 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 54.33 36.1 24.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.076 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.47 39.59 11.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -174.03 162.89 3.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.44 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 43.1 p-80 -86.79 117.88 25.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.959 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.429 ' CZ2' ' HB3' ' A' ' 64' ' ' ALA . 86.0 m95 -108.09 124.6 50.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.74 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.419 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.09 174.45 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.964 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -80.06 -38.37 32.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.353 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -91.19 -22.17 20.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.958 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.7 m -95.53 26.76 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 56.0 tp -129.89 88.68 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.835 0.35 . . . . 0.0 111.023 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 161.54 37.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -59.02 147.0 36.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -75.6 -31.07 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -95.8 -60.6 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -60.25 -34.83 74.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.873 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 58.19 31.15 20.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.014 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.0 t -97.86 133.01 23.8 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.99 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.1 118.97 3.1 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.542 2.162 . . . . 0.0 112.557 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -101.86 77.47 1.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.825 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -108.92 38.15 2.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -152.68 -66.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.04 133.86 50.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 t -123.36 128.04 49.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.41 ' CD1' ' HG2' ' A' ' 25' ' ' GLU . 0.4 OUTLIER -112.35 153.64 26.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.2 t -127.43 117.82 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.881 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -149.71 123.96 9.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.47 50.22 45.39 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.482 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 68.91 -67.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 m -58.43 151.2 20.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.952 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.06 134.76 27.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.047 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -122.94 156.38 34.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.937 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.4 p -112.78 135.94 52.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.692 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.447 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -51.97 -35.57 46.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.188 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -45.14 -48.89 12.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.45 -20.8 33.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.85 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.437 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 11.1 t80 -64.13 -34.96 79.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.447 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 40.6 m-85 -65.11 -40.94 95.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.93 0.395 . . . . 0.0 110.756 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -74.8 -56.52 4.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.311 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -73.49 -51.92 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.468 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.437 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 96.6 m-85 -98.53 37.01 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.203 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.99 -143.71 3.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 80.7 m -103.07 155.0 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.711 0.291 . . . . 0.0 110.814 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -151.62 158.42 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.875 0.369 . . . . 0.0 111.191 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.28 136.78 42.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.722 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.46 30.23 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.23 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -58.15 1.47 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 18.0 p -110.37 18.2 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.211 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 54.41 28.37 9.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.778 0.323 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 14.4 tp -100.86 134.71 43.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.829 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.0 110.87 3.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.625 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.43 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 11.4 mt -63.7 139.56 97.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.555 0.216 . . . . 0.0 110.895 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.548 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 91.9 Cg_exo -44.59 172.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.672 2.248 . . . . 0.0 112.598 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.09 -55.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.908 2.405 . . . . 0.0 114.464 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.401 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.32 21.39 7.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.548 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 67.0 mm-40 -61.22 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.471 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.81 112.16 36.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.946 0.403 . . . . 0.0 111.079 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 8.7 p -157.05 161.39 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.733 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.25 134.92 38.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.639 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.91 136.57 52.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.811 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.433 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -72.68 96.32 1.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.861 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 38.1 -89.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.2 m-20 -79.05 -38.5 36.3 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.205 -177.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.41 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.7 m-85 -105.84 168.19 9.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 46.9 t -122.58 148.12 26.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.514 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.43 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 3.9 m-85 -133.56 170.18 15.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.118 0.485 . . . . 0.0 111.733 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.427 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 0.1 OUTLIER -65.83 168.78 7.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.907 179.729 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.04 -29.96 34.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -91.42 -49.3 6.41 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.11 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.427 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 79.7 m -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.245 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.449 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 2.6 t80 -56.84 114.58 2.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.021 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.1 -177.02 1.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 30.6 t -97.68 150.07 21.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 21.3 m -66.81 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.283 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -106.22 -55.88 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.345 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 25.8 m -65.84 -28.19 68.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.005 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? 54.73 31.65 15.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.69 146.83 46.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.855 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -62.19 154.13 28.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.434 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.7 mm? -112.16 123.27 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -98.88 157.67 16.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.0 t -44.69 133.51 5.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.26 -32.98 6.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.628 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.15 131.06 45.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 0.0 110.812 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.04 113.89 24.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.031 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 9.0 p90 -126.49 153.27 45.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.927 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m-85 -102.16 163.27 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.743 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.6 tp -120.7 112.11 18.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.801 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.14 167.85 2.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.36 -29.65 67.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.5 -79.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.038 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.43 38.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.823 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -105.54 117.58 34.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 1.2 mp -69.4 127.22 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.07 126.66 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.056 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.1 m -58.77 -170.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.811 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -73.42 -55.86 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.71 -43.91 97.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.101 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -59.37 -25.76 64.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.056 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -55.83 -66.09 0.48 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.999 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -56.44 -28.14 58.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.118 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -30.5 43.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.985 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -90.45 -29.18 18.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.246 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm 61.88 174.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.847 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.853 -179.917 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.811 0.339 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t -154.98 161.63 41.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -175.63 115.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -131.79 150.34 75.94 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.075 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 -167.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.529 2.153 . . . . 0.0 112.298 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -124.51 112.58 17.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.423 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 10.9 p -126.05 158.6 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.072 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -139.51 -177.4 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.639 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 p -155.06 135.7 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.227 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG22 ' CE1' ' A' ' 163' ' ' PHE . 57.5 t -58.9 146.17 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.01 -153.18 8.7 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.664 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 60.0 mt-10 -67.66 141.51 95.19 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.534 0.207 . . . . 0.0 110.748 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 4.0 Cg_endo -83.03 129.91 5.48 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.716 2.277 . . . . 0.0 112.396 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -156.43 155.17 31.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.349 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.2 mt -136.28 173.38 11.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.874 0.369 . . . . 0.0 111.091 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.66 -50.66 32.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.777 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 63.13 88.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.583 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.98 -41.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.424 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 58.4 23.27 10.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.75 0.31 . . . . 0.0 111.026 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 56.95 -172.91 0.08 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.872 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.18 136.76 7.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.89 -31.23 61.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.748 0.308 . . . . 0.0 110.854 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.15 -27.9 61.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.038 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -56.31 -31.18 63.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.025 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.7 OUTLIER -113.01 174.19 6.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -75.98 121.61 22.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.834 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tp -105.13 163.68 12.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.893 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 8.3 pt -63.04 146.31 12.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.139 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 50.3 m -113.46 106.84 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.833 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -77.08 101.75 6.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.491 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.03 155.9 42.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.968 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -77.72 152.35 33.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -99.24 -27.52 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.8 m 63.37 37.56 10.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.817 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -124.44 73.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.836 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE2' ' NH1' ' A' ' 73' ' ' ARG . 2.2 t80 -70.55 -44.4 67.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -102.06 141.32 35.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.12 -40.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.068 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -166.09 107.08 0.71 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 60.35 35.33 20.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -96.62 -29.07 8.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.499 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.42 ' N ' ' CD1' ' A' ' 42' ' ' ILE . 2.5 mp -84.19 -72.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.816 0.341 . . . . 0.0 110.858 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.85 -177.13 2.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.872 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -132.83 125.34 29.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -60.37 162.57 6.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.899 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.85 59.1 0.64 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.569 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -161.3 146.79 12.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.491 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -131.72 -46.46 0.96 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 0.0 110.936 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.91 -97.95 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.529 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.75 -162.21 2.54 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.523 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -155.43 100.58 2.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.806 0.336 . . . . 0.0 110.851 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 43.3 mtp -144.08 118.75 9.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.901 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.05 77.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.534 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.6 m 60.55 171.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 110.926 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -103.9 -157.51 24.32 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.433 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -91.2 -160.87 36.84 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.483 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.51 87.5 14.19 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.638 0.256 . . . . 0.0 110.9 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.47 165.53 1.02 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.558 2.172 . . . . 0.0 112.265 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 59.71 31.16 20.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.29 134.93 19.56 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.053 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.14 125.9 18.79 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.405 2.07 . . . . 0.0 112.031 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.5 mtt -99.19 135.94 39.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.417 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 0.1 OUTLIER -58.03 147.54 29.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.654 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.477 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -62.12 114.82 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.068 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 97.37 -22.24 41.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.967 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.76 -178.82 6.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -144.4 46.88 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.01 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -150.68 -83.35 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.014 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 176.03 -177.55 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.933 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.417 HG13 ' CD2' ' A' ' 82' ' ' HIS . 7.7 mm -126.93 153.72 36.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -172.79 35.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.886 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -100.3 -179.54 4.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.938 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' NH1' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -81.73 -79.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.92 132.75 38.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.5 mm -136.03 152.48 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.115 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' LEU . 6.0 mp -106.97 106.91 17.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.437 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -90.84 120.83 32.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' A' ' 83' ' ' TRP . . . -153.87 154.75 34.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.114 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.411 HD11 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.74 37.72 28.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.21 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.72 40.68 12.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.911 0.386 . . . . 0.0 111.145 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -176.64 159.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.822 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.417 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 29.9 p-80 -85.17 117.93 24.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.477 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 77.9 m95 -106.93 122.92 47.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.608 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.98 151.84 11.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.894 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -59.01 -35.89 74.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.843 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mttt -91.15 -48.9 6.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.94 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 21.0 m -58.48 -27.95 64.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.117 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 54.6 tp -72.17 88.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.886 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 24.3 mmtt -134.96 159.29 41.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 53.3 t -60.75 147.03 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.79 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -62.59 -39.91 95.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.506 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -99.7 -63.12 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.434 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.2 m -56.36 -33.23 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.314 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 53.68 24.98 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.026 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -86.03 161.51 49.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.261 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.18 118.96 5.58 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.594 2.196 . . . . 0.0 112.309 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 mp -126.83 74.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.809 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -116.64 30.98 7.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -137.43 -55.04 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.07 47.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.933 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.6 t -113.02 163.87 14.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.834 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.451 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 1.9 t80 -165.32 120.95 1.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.1 p -151.98 172.35 16.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -167.43 123.99 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.5 -87.1 1.31 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.471 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -150.77 36.25 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.883 0.373 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.7 m -156.23 142.5 18.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.1 p -112.6 115.98 51.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -130.08 121.03 25.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.84 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.0 p -49.63 173.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.224 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 11.7 mtpt -78.16 -28.79 48.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.44 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.4 t70 -52.91 -52.91 56.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.264 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -84.05 -20.7 32.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.277 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.484 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 14.4 t80 -61.48 -33.3 73.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.0 110.758 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.6 m-85 -59.71 -45.34 92.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.77 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -74.68 -27.02 60.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.005 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -64.2 -54.99 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.223 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -117.03 -42.99 2.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -56.93 171.89 2.46 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -58.93 149.22 27.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.789 0.328 . . . . 0.0 110.931 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -150.88 162.13 41.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 16.1 t -79.0 155.8 28.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.953 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -111.09 -20.56 12.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.363 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -78.22 -58.03 3.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.05 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.26 -12.08 21.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.186 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 36.75 12.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.414 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.5 tp -109.49 144.17 38.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.44 104.25 0.74 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.553 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.465 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 64.8 mt -61.42 140.38 94.75 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.638 0.256 . . . . 0.0 110.987 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.543 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 83.8 Cg_exo -43.97 170.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.874 2.383 . . . . 0.0 112.814 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.35 -55.58 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.479 2.12 . . . . 0.0 114.831 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.403 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.63 21.48 7.07 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.543 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 84.2 mm-40 -59.57 -178.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.791 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.52 114.35 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.071 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' THR . 11.4 p -157.05 164.56 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.68 34.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.346 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.61 133.52 49.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.018 -179.267 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -67.96 96.31 0.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.761 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.97 -89.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.4 t70 -80.64 -39.53 27.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.377 -177.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 138' ' ' ALA . 2.9 m-85 -106.65 173.35 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.852 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.432 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 7.9 p -126.65 149.0 31.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.604 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.423 ' CE1' ' HB2' ' A' ' 138' ' ' ALA . 3.6 m-85 -131.88 158.88 40.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 111.364 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 76.7 m80 -71.53 137.92 48.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.042 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.428 ' N ' HG21 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -62.54 -17.79 60.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.345 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.33 -37.37 21.7 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.393 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 7.7 p -96.43 -19.05 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.455 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 4.8 t80 -60.1 119.53 8.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.708 0.29 . . . . 0.0 110.804 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.02 -176.87 1.77 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.207 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.67 150.06 25.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 5.4 m -68.98 -30.16 45.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.143 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.48 -52.61 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.173 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 13.8 m -66.04 -28.1 68.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.005 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 58.01 34.58 24.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.995 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -115.47 137.33 52.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -64.63 155.25 33.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.025 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.469 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.1 mm? -115.44 164.25 14.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.682 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 169.34 18.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.418 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 m -42.79 122.19 2.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.71 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.24 -22.87 36.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.724 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.35 128.88 37.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 110.774 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -91.31 115.35 27.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.426 ' CE1' HG22 ' A' ' 10' ' ' VAL . 8.3 p90 -137.44 169.26 18.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.021 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.495 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 87.2 m-85 -115.51 171.01 7.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.93 116.45 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.821 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mtp -72.26 -176.24 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.976 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.01 -26.22 31.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.18 30.33 2.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.049 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 12.9 p 58.32 45.35 17.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.025 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.06 155.3 19.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.455 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -105.06 123.47 47.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.9 p -142.54 125.26 13.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.06 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 23.3 p -78.53 -171.0 2.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.951 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -79.1 -30.18 43.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.149 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.55 -34.94 79.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.389 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -104.14 4.11 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.594 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 8.8 t80 -65.93 -66.12 0.59 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 110.778 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -59.12 -26.06 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.032 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.5 m -72.98 -27.69 61.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.093 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.35 -32.12 12.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.914 0.387 . . . . 0.0 110.738 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . 0.425 ' HE3' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER 179.29 171.54 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.929 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.876 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.896 0.379 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 t -170.8 -171.14 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -71.43 146.3 48.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.2 m -101.81 150.33 37.27 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -51.73 -27.37 26.39 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.585 2.19 . . . . 0.0 112.375 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 61.24 101.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.818 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.434 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.8 p -96.91 155.64 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.195 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.461 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -154.98 -173.12 4.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.627 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.0 p -155.06 144.8 13.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.223 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.427 HG22 ' CE1' ' A' ' 163' ' ' PHE . 32.6 t -67.79 146.2 13.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.688 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -129.92 -176.18 14.33 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.629 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 3.6 mm-40 -59.85 148.2 76.95 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 120.573 0.225 . . . . 0.0 110.775 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 4.6 Cg_exo -77.92 137.02 15.38 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.642 2.228 . . . . 0.0 112.586 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.01 142.85 5.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.985 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.411 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.7 OUTLIER -120.53 173.6 7.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.202 0.525 . . . . 0.0 111.445 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.17 -28.84 64.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.017 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 58.72 56.28 26.16 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.304 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.52 -50.17 70.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.6 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 70.08 -64.81 0.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.48 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER 62.85 163.14 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.907 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.46 -170.94 44.1 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.577 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -59.19 -28.47 66.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 0.0 111.078 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -56.64 -29.47 62.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.52 -75.28 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' CG ' ' CE2' ' A' ' 102' ' ' PHE . 52.4 mm-40 -113.57 172.83 6.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.845 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ptp85 -76.04 144.49 40.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.5 tp -111.99 163.68 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.6 pt -62.93 161.83 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.176 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -130.81 106.85 8.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.3 101.8 7.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.534 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.62 150.36 40.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.417 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 2.8 mt-10 -68.48 157.06 36.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -123.7 19.5 9.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.226 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.6 t 43.95 31.21 0.48 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.382 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -120.24 162.3 19.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -177.14 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -114.04 107.3 15.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.956 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -169.29 120.42 0.71 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.076 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.79 18.35 10.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.449 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.5 m120 61.63 81.53 0.19 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.7 -83.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.513 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.421 ' N ' ' CD1' ' A' ' 42' ' ' ILE . 2.5 mp -84.25 -55.76 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -105.98 174.52 5.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.91 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -133.04 122.52 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.76 105.19 15.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.903 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.54 -61.51 0.21 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.482 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.04 28.54 9.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.39 141.07 45.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.848 0.356 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.86 97.41 1.35 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.493 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.91 28.73 5.8 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.445 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 84.84 1.59 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.346 . . . . 0.0 110.874 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.3 mtt -137.76 35.06 2.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.07 -33.15 0.15 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.539 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -60.31 -70.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.872 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -86.58 126.87 8.09 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.545 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -174.3 161.05 30.93 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.511 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.89 86.93 2.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.727 0.299 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.38 161.35 46.23 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.497 2.132 . . . . 0.0 112.246 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 60.2 33.84 21.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.438 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -108.94 134.63 20.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.17 125.99 19.0 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.435 2.09 . . . . 0.0 112.119 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.38 140.51 30.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.107 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.0 p -58.07 164.2 2.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.975 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' HB3' ' CZ2' ' A' ' 83' ' ' TRP . . . -86.46 114.59 23.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.515 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.83 -69.81 0.46 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.6 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.1 p -105.25 153.77 21.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -74.52 87.13 2.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.21 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -179.22 133.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.438 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 12.6 p80 -72.1 143.62 48.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.453 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 4.9 mm -70.76 152.08 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -174.21 35.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.91 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -107.53 162.84 13.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.925 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -59.64 -74.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.417 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -82.91 120.87 26.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.021 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.32 146.68 28.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.205 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.7 106.67 17.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.435 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -91.48 127.61 36.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -166.68 165.24 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.188 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.2 mt 59.25 37.25 23.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.109 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.83 29.52 17.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.014 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -169.89 -179.15 3.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 25.9 p-80 -97.2 124.63 41.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.87 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.427 ' CZ2' ' HB3' ' A' ' 64' ' ' ALA . 37.4 m95 -115.77 130.58 56.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.718 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.453 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.99 170.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.909 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 p -80.02 -40.07 28.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.0 mttm -90.57 -26.85 19.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.4 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 68.4 m -71.06 -30.27 66.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.971 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.4 tp -76.6 80.3 3.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.852 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -135.94 153.18 51.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.71 135.48 48.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.766 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -29.21 68.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.063 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.24 -62.92 1.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.146 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.9 m -58.28 -34.98 71.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 55.33 23.72 5.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.112 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.5 m -85.97 156.37 57.9 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.216 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.55 118.95 5.92 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.497 2.131 . . . . 0.0 112.308 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.0 mp -104.02 65.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -98.05 30.25 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.111 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -140.26 -51.94 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.25 174.36 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.2 t -157.01 141.6 16.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.449 ' CE2' ' CG ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -133.98 172.04 13.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -147.61 155.26 41.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -170.28 124.04 0.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.23 -90.62 0.36 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.444 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -153.87 36.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 m -153.21 153.08 32.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.3 p -85.71 116.02 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.04 160.19 20.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -97.98 171.22 8.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.743 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 1.5 mttt -78.16 -32.9 50.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.477 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.5 -58.08 7.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.543 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -72.92 -20.83 61.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 4.4 t80 -64.38 -33.55 76.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 110.953 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.421 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 4.9 m-85 -79.15 -35.24 42.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.01 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -84.96 -59.05 2.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.284 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -71.54 -47.36 55.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.387 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -98.07 37.03 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.361 . . . . 0.0 111.064 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -149.06 -178.95 24.54 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.36 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 72.4 m -60.11 153.53 21.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.794 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -144.44 174.27 11.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.126 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 41.8 t -93.4 130.76 39.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.799 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.81 29.53 3.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.111 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.454 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.12 -53.27 1.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.26 -8.34 14.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.323 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 64.07 64.73 0.73 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.934 0.397 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 5.2 tp -134.63 175.77 9.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -99.15 99.15 2.08 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.718 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.424 HG13 ' CE1' ' A' ' 144' ' ' HIS . 1.7 mp -74.45 138.14 74.6 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.424 0.154 . . . . 0.0 110.692 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.594 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 89.6 Cg_exo -44.4 173.2 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.596 2.197 . . . . 0.0 112.59 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.69 -55.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.861 2.374 . . . . 0.0 113.814 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -120.23 21.72 11.63 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.594 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.6 OUTLIER -67.95 137.55 55.25 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.584 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.5 t -74.14 108.77 5.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.43 ' O ' ' N ' ' A' ' 14' ' ' THR . 11.3 p -143.08 158.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.773 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 134.81 39.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.893 0.378 . . . . 0.0 110.777 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -104.96 112.92 26.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.893 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 139' ' ' GLN . . . -79.82 146.92 32.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.795 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 138' ' ' ALA . 18.0 pm0 42.64 -142.28 0.11 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.334 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -89.74 35.26 0.83 Allowed 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -151.41 169.0 23.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.914 0.388 . . . . 0.0 111.039 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.7 p -103.57 148.65 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.047 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.454 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 6.9 m-85 -126.89 175.06 8.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.967 0.413 . . . . 0.0 111.21 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.8 m80 -104.95 136.85 43.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.75 -22.4 23.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 177.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.33 -36.0 14.1 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.674 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.416 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -97.14 1.65 50.18 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.433 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.5 t80 -86.03 115.84 23.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.777 0.323 . . . . 0.0 110.645 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.0 -176.95 1.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.259 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.54 150.21 20.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.025 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 14.2 m -67.44 -27.29 38.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.289 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 28.3 t -104.11 -55.7 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.424 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 30.1 m -65.94 -28.04 68.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.981 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm 57.53 28.5 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.999 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 34.2 mtm180 -121.74 147.75 45.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -66.76 153.43 43.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.038 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.451 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.1 mm? -115.89 139.93 49.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.728 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -107.37 167.0 10.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.163 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 t -46.79 138.55 6.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.33 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.33 -32.59 6.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.499 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -63.81 128.92 37.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.766 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -93.7 116.18 28.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.994 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.461 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 13.8 p90 -126.91 166.28 17.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.917 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.434 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 23.4 m-85 -117.27 171.17 8.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.144 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.2 tp -124.38 111.02 15.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.429 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 2.8 mmt -60.94 -89.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.264 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -83.23 -49.16 9.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.802 0.334 . . . . 0.0 111.097 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.3 t0 176.82 -38.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.748 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 33.7 p -115.4 30.76 7.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.9 mtt180 -120.48 132.21 55.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.453 ' CD1' ' CE2' ' A' ' 143' ' ' TYR . 0.2 OUTLIER -103.84 123.69 47.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.837 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 13.4 p -145.07 118.92 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.094 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.3 m -55.37 -176.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.015 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -69.31 -49.0 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.17 84.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -59.45 -25.95 64.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.937 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -54.54 -65.31 0.6 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.018 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -54.13 -23.49 14.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.304 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.0 m -87.07 -26.77 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -52.07 4.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.487 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 171.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.927 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 -179.959 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.39 79.88 8.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 118.3 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.2 m -59.96 109.87 2.34 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.135 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.02 -42.58 3.02 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.381 2.054 . . . . 0.0 112.298 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -156.52 115.85 3.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.976 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.424 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 11.0 p -125.93 158.72 34.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.092 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.446 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -146.1 -179.3 6.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.679 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.4 p -155.02 135.38 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.29 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG21 ' CE1' ' A' ' 163' ' ' PHE . 41.3 t -59.03 146.27 9.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.489 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -136.12 -159.75 8.57 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.743 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.33 123.27 69.35 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.514 0.197 . . . . 0.0 110.901 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.03 138.42 72.96 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.309 2.006 . . . . 0.0 112.263 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -166.03 148.56 7.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.414 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 1.1 mt -116.84 173.4 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.294 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -37.09 77.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.866 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 57.44 81.54 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.543 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.84 -72.29 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 60.67 86.87 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.782 0.325 . . . . 0.0 110.826 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.524 ' CZ ' ' CE1' ' A' ' 115' ' ' PHE . 29.7 p90 -59.79 -44.47 93.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.036 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.436 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 57.39 -120.91 23.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.563 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -83.94 -23.86 30.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.733 0.301 . . . . 0.0 111.168 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.99 -29.98 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.175 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.19 -73.55 0.39 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.874 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.403 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 19.9 tp10 -120.99 163.49 18.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 147.87 38.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -101.58 165.13 11.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.972 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.403 ' CD1' ' N ' ' A' ' 99' ' ' GLU . 4.1 pt -62.97 144.01 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.147 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.6 m -110.29 106.85 16.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 101.83 10.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.552 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.35 157.16 44.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.996 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -87.04 157.05 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -110.83 -178.09 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 p -120.64 37.22 4.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -90.42 -54.03 4.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.0 t80 68.5 -68.1 0.18 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.9 -65.26 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.07 -79.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.211 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.24 17.41 2.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.919 0.39 . . . . 0.0 111.434 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -176.64 141.83 0.4 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.909 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 147.97 45.61 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.481 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.424 ' N ' ' CD1' ' A' ' 42' ' ' ILE . 2.5 mp -84.24 -72.37 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 110.866 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -132.1 -177.1 4.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.47 87.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -83.54 108.73 16.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.882 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -140.96 113.89 0.89 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.496 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.25 -95.74 1.42 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.51 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 m -158.24 102.93 1.79 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.869 0.366 . . . . 0.0 110.858 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 153.1 49.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.495 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.18 32.99 2.36 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.534 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -132.17 82.37 2.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.895 0.379 . . . . 0.0 110.911 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -60.87 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -172.12 47.34 0.18 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.548 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.15 172.1 19.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.95 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 101.51 -174.64 24.98 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.458 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.27 93.39 1.03 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.487 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.98 87.41 51.77 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.767 0.318 . . . . 0.0 110.888 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -51.72 164.7 0.91 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.554 2.169 . . . . 0.0 112.293 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 59.31 31.2 20.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.422 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.3 tp -109.79 135.0 20.46 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.56 125.95 18.66 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.379 2.053 . . . . 0.0 112.144 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.54 139.34 30.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.9 p -57.73 164.22 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . . . -86.3 114.67 23.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.44 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.45 -75.04 0.38 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.607 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.2 p -98.78 152.33 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 110.941 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 87.25 1.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.02 136.85 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.422 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.5 p80 -73.76 151.48 40.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.972 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.456 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -79.69 153.51 4.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.908 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.403 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.6 OUTLIER -173.41 35.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -109.3 163.05 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -77.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.42 120.57 22.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.9 mm -122.83 154.02 27.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.205 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -112.2 106.83 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.369 179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -90.85 129.39 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.967 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -161.41 162.78 30.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.182 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.401 ' CD1' ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 55.01 36.13 26.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.14 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 62.5 30.19 17.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.012 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -164.03 170.11 17.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 30.8 p-80 -88.38 120.94 30.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.425 ' CZ2' ' HB2' ' A' ' 64' ' ' ALA . 47.4 m95 -110.17 130.04 55.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.456 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.54 174.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.7 t -79.99 -42.17 24.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -90.35 -29.75 17.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.956 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.6 m -69.63 -31.41 69.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.4 ' CD1' ' CB ' ' A' ' 83' ' ' TRP . 7.3 tp -72.82 77.52 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -137.05 165.46 25.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.809 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.59 147.07 39.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -28.49 67.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.013 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -111.49 -57.24 2.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 26.9 m -57.76 -46.1 85.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.067 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 94' ' ' HIS . 10.5 t-160 58.31 21.7 8.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 13.3 m -86.47 155.69 56.74 Favored Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.118 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 118.98 5.95 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.495 2.13 . . . . 0.0 112.081 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.4 mp -107.59 64.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.805 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -100.04 30.66 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.112 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.403 ' N ' ' CD1' ' A' ' 28' ' ' ILE . 15.3 mm-40 -138.48 -47.23 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.58 148.12 26.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.816 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.2 128.24 18.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.415 ' CD1' ' HG3' ' A' ' 111' ' ' LYS . 0.6 OUTLIER -111.52 172.03 7.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.807 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 p -152.24 122.72 7.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.946 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.13 124.06 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.13 -102.02 2.01 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.495 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -143.56 34.92 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -153.33 152.46 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.98 124.47 36.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.058 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -121.01 143.31 49.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.002 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.0 p -87.91 153.54 21.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 29.6 mtpt -56.21 -34.69 66.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.927 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -63.43 -28.05 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -83.91 -22.95 31.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.202 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.516 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 8.8 t80 -73.86 -49.81 23.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.029 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.524 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 m-85 -51.88 -40.23 60.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.853 0.359 . . . . 0.0 111.239 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -85.07 -64.11 1.21 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.465 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -59.91 -49.27 78.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.58 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -109.26 37.02 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -164.39 168.1 38.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.6 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.41 ' CG2' ' CG1' ' A' ' 142' ' ' VAL . 85.8 m -61.55 154.99 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.69 0.281 . . . . 0.0 110.659 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -162.11 161.15 28.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 111.168 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.02 137.27 56.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.84 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.6 29.76 3.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -58.18 1.47 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.292 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 17.1 p -110.85 8.15 22.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.46 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 59.51 29.44 19.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.697 0.284 . . . . 0.0 111.069 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 tp -92.18 121.69 33.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.48 112.08 3.42 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.763 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.425 HG21 ' HD2' ' A' ' 130' ' ' PRO . 4.2 mt -71.77 132.92 84.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.614 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 76.1 Cg_exo -47.37 176.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.297 1.998 . . . . 0.0 112.592 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.03 -52.13 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.113 2.542 . . . . 0.0 113.632 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.03 22.02 7.39 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.614 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -55.88 -169.94 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.678 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -120.14 108.81 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.019 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.1 p -157.05 160.93 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.61 134.87 39.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.487 179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 135.87 52.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.878 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.422 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -71.21 96.67 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.977 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.65 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.359 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 138' ' ' ALA . 3.2 t70 -90.55 -46.07 8.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.782 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.644 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.41 ' CG1' ' CG2' ' A' ' 120' ' ' THR . 10.5 p -117.1 150.61 19.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.679 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -132.16 174.95 9.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -79.43 165.24 23.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.913 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.3 mp -81.07 -32.32 34.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -91.36 -49.29 6.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.727 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 69.3 m -53.55 -29.6 37.71 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.127 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.416 ' CZ ' HD23 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.89 114.68 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.086 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.19 154.24 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.035 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.56 149.96 28.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 5.1 m -63.9 -28.22 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.402 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.7 t -109.07 -56.7 4.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.338 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 31.7 m -65.92 -28.13 68.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.172 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 68.5 mttt 49.93 48.57 21.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -118.35 136.66 53.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.026 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.2 149.51 19.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.319 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -114.9 162.26 17.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.499 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 172.56 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 3.5 m -45.43 125.34 5.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.398 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.87 -22.76 37.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.694 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -62.19 128.9 38.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 110.765 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -87.98 123.42 32.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.94 0.4 . . . . 0.0 111.098 -179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.446 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 8.3 p90 -144.0 156.4 44.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.424 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 47.4 m-85 -108.62 171.1 7.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -125.31 121.34 33.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.853 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 6.7 mmt -81.6 166.97 19.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -65.86 -28.43 68.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -97.68 29.23 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.2 57.04 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 4.6 mtt180 -125.66 128.29 47.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 163' ' ' PHE . 3.0 mp -78.6 133.29 37.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.5 p -145.06 137.27 21.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.935 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.6 p -81.56 169.13 17.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -59.13 -51.79 68.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.6 -25.47 52.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.293 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -96.81 -14.54 21.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.381 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.401 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 7.2 t80 -57.58 -66.0 0.54 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.371 . . . . 0.0 110.911 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.36 -28.49 70.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.139 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.9 m -75.33 -33.3 61.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.062 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -88.9 -49.58 6.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.216 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm 62.34 175.36 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.927 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.933 179.99 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.766 0.317 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.06 161.02 28.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -176.49 -40.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.2 m -87.49 148.66 44.81 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.12 -45.81 0.82 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.521 2.148 . . . . 0.0 112.286 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -176.43 78.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.422 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 13.2 p -100.53 158.89 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.164 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.42 ' HE3' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -157.21 -170.61 3.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.667 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.5 p -155.04 147.59 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 163' ' ' PHE . 22.5 t -61.85 146.31 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.652 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.4 -163.54 10.49 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.521 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.69 130.04 84.26 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.449 0.166 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -60.67 146.91 96.37 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.269 1.979 . . . . 0.0 112.399 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.13 160.56 24.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.465 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.43 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.2 OUTLIER -144.02 173.58 11.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.066 0.46 . . . . 0.0 111.36 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -39.85 94.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.403 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 57.39 83.02 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.642 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.34 -126.01 3.24 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.32 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 170.51 -33.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 110.826 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 3.4 t80 69.18 161.67 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.869 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -111.02 127.14 8.1 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.627 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -84.05 -30.42 26.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.875 0.369 . . . . 0.0 110.936 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -58.07 -24.51 58.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.114 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.66 -30.13 54.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.06 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.9 OUTLIER -109.14 175.99 5.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.908 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.7 mmt85 -94.38 99.97 12.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.96 161.34 30.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.864 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.403 ' CG2' ' CD2' ' A' ' 88' ' ' LEU . 6.2 pt -62.99 138.52 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 m -100.52 106.84 18.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.2 mtm-85 -84.69 101.73 12.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.377 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 151.43 51.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.88 96.97 3.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.34 116.15 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -65.59 79.22 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -151.8 78.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -96.02 -31.49 13.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -127.42 115.66 19.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -165.11 -43.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.125 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.27 107.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.068 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.24 34.99 20.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.34 -57.29 2.38 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.45 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 42.2 mm -82.03 154.17 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.847 0.356 . . . . 0.0 110.917 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.55 157.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.36 157.73 16.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -99.17 117.2 33.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 164.58 55.26 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.454 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 178.43 -148.44 8.44 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.515 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 94.5 p -176.5 126.63 0.18 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 110.897 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -140.64 31.72 2.2 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.547 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 137.44 -111.04 0.8 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.49 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -105.5 -56.64 2.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.6 mmt 60.54 176.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 137.53 -178.13 19.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.465 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.58 -67.79 0.44 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.772 0.32 . . . . 0.0 110.895 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 137.59 -150.3 20.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.518 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -145.04 151.62 23.77 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.44 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.07 86.12 55.34 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.688 0.28 . . . . 0.0 110.851 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.37 164.07 35.56 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.562 2.175 . . . . 0.0 112.209 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 59.08 31.61 21.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.857 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.422 HG23 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -106.56 134.7 19.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.112 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.17 125.99 18.33 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.388 2.059 . . . . 0.0 112.084 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.9 139.81 30.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.069 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.7 p -57.54 164.14 2.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.958 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.411 ' HB2' ' CD2' ' A' ' 83' ' ' TRP . . . -86.31 114.61 23.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.481 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.06 -71.36 0.44 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.601 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.8 p -103.56 152.94 21.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.774 0.321 . . . . 0.0 110.981 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.45 87.2 2.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.11 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -178.79 135.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.422 ' CD2' HG23 ' A' ' 60' ' ' ILE . 10.9 p80 -71.39 143.47 50.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 3.4 mm -68.76 147.62 12.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.407 ' CD2' ' CE1' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.7 35.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.929 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -111.39 144.6 40.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.91 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.403 ' HG2' ' N ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -56.94 -34.26 67.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.109 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.403 ' N ' ' HG2' ' A' ' 73' ' ' ARG . 2.0 m-85 -106.19 112.03 24.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mm -132.61 147.48 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 111.253 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -109.82 107.35 17.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.286 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -90.77 122.5 33.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.055 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -164.71 167.1 19.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.118 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mt 62.95 37.04 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 29.18 17.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.065 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -170.62 -179.56 2.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 26.7 p-80 -97.99 124.45 42.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.972 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.411 ' CD2' ' HB2' ' A' ' 64' ' ' ALA . 42.2 m95 -116.54 130.8 56.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.779 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.71 172.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p -79.57 -40.62 29.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -91.0 -28.47 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.54 -31.15 68.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.993 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.403 ' CD2' ' CG2' ' A' ' 28' ' ' ILE . 5.2 tp -80.86 94.38 6.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.976 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -144.07 156.77 44.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 23.7 t -60.0 147.13 40.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.805 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.3 m -74.21 -28.88 61.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.173 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -101.39 -63.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.135 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 37.2 m -60.07 -30.69 69.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.097 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 57.31 23.18 8.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.0 m -85.81 156.31 58.38 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.247 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.57 118.93 5.96 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.525 2.15 . . . . 0.0 112.297 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -103.8 86.69 2.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -114.84 30.5 7.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.092 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -140.03 -47.37 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -150.81 146.46 26.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.811 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 14.5 t -126.13 158.92 34.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.423 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.62 119.98 5.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.8 p -139.11 150.86 46.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.24 124.0 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.828 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -114.4 4.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.535 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -123.87 32.99 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 0.0 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.2 m -157.69 166.89 31.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.5 p -129.33 115.98 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.077 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.2 OUTLIER -131.7 132.42 43.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -52.06 167.02 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.423 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 1.7 mtmt -67.19 -30.43 70.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.423 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 4.8 t70 -55.2 -48.86 73.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -72.23 -20.9 61.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.051 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 118' ' ' PHE . 10.4 t80 -66.4 -41.05 89.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.951 0.405 . . . . 0.0 110.809 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.423 ' CZ ' ' HD2' ' A' ' 111' ' ' LYS . 6.4 m-85 -67.77 -26.16 65.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.944 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -43.81 25.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.21 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.445 ' NH1' ' CD2' ' A' ' 109' ' ' TYR . 14.4 ptp180 -79.27 -47.24 16.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.382 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 114' ' ' PHE . 76.3 m-85 -84.52 -43.02 14.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.99 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.94 167.89 40.57 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.574 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.8 m -59.58 152.93 20.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.6 172.24 14.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.069 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.2 t -63.77 138.57 58.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.71 29.53 2.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.995 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.22 -58.13 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.963 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 16.3 p -108.24 12.66 26.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.289 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 54.12 30.0 11.33 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.87 0.367 . . . . 0.0 111.083 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 18.6 tp -94.1 138.65 31.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.909 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -65.4 130.79 34.98 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 22.3 mt -87.0 126.82 61.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.435 0.159 . . . . 0.0 110.817 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.603 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 86.0 Cg_exo -44.43 173.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.72 2.28 . . . . 0.0 112.706 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.87 -55.12 0.22 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.866 2.377 . . . . 0.0 113.684 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.403 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.2 21.42 7.36 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.296 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.603 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.0 OUTLIER -59.02 138.54 57.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.388 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -78.14 108.64 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.988 0.423 . . . . 0.0 110.891 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.9 p -143.12 161.04 17.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.78 134.98 39.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.929 0.395 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.19 157.89 16.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.956 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.419 ' HB3' ' CD1' ' A' ' 143' ' ' TYR . . . -100.6 96.75 7.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.756 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 57.38 -86.52 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.497 0.665 . . . . 0.0 111.821 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -100.22 -48.97 4.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.783 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -82.59 161.78 22.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.628 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.6 p -106.31 151.28 8.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.672 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 138' ' ' ALA . 19.5 m-85 -129.68 174.97 9.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.036 0.446 . . . . 0.0 111.394 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.0 160.73 27.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.773 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 16.3 tp -81.03 -31.3 34.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.857 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -91.27 -49.28 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.913 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 74.3 m -53.35 -30.14 37.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.231 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.444 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 1.3 t80 -56.84 116.16 3.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.099 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.16 -177.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.926 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.0 t -99.88 150.04 22.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 6.0 m -65.91 -26.37 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.314 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 25.7 t -107.89 -55.76 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.371 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.01 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 53.9 34.98 20.65 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.159 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -124.68 143.93 50.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -59.01 154.06 16.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.447 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.6 mm? -111.77 123.05 49.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -99.25 158.18 15.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.7 t -44.84 132.48 6.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.534 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 106.81 -32.38 7.32 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.548 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.02 133.61 46.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.834 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -87.97 116.12 25.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.027 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 10' ' ' VAL . 8.2 p90 -126.5 144.65 50.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.422 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 5.0 m-85 -96.97 147.39 24.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.3 tp -106.53 110.94 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.6 mmt -72.52 150.01 43.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -59.36 -28.76 67.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.012 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -97.48 36.2 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.996 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 3.1 p 49.97 83.6 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.184 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -156.43 120.38 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.444 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 1.2 mp -80.12 126.5 31.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.09 127.87 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 52.6 m -58.34 -173.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.411 ' HE3' ' CE2' ' A' ' 164' ' ' TYR . 0.1 OUTLIER -72.8 -49.59 29.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -68.2 -44.12 76.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.119 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -58.81 -23.61 60.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.37 -65.97 0.5 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.46 -27.89 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.14 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.3 m -78.56 -30.44 46.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.065 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.88 16.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.257 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm 61.32 175.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.797 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.92 179.993 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.886 0.374 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.3 t -81.6 122.23 27.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.856 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.75 173.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.1 m -158.88 87.0 2.25 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.051 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.96 143.75 50.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.561 2.174 . . . . 0.0 112.33 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -176.09 -171.62 0.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.446 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p -58.37 142.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.895 0.378 . . . . 0.0 111.21 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.448 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -158.08 -175.87 5.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.527 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.0 p -155.03 131.82 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.185 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.435 HG23 ' CE1' ' A' ' 163' ' ' PHE . 57.8 t -55.71 146.3 5.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.667 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.5 -161.42 10.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.513 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -61.68 139.46 95.3 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.512 0.196 . . . . 0.0 110.759 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.69 132.66 12.2 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.572 2.181 . . . . 0.0 112.193 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.02 155.74 25.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.479 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 1.2 mt -131.6 173.53 11.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.175 0.512 . . . . 0.0 111.525 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.6 -32.14 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.745 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.402 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 56.59 58.57 13.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.531 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -91.49 -75.34 1.3 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.563 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 65.56 77.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.478 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.8 OUTLIER -57.89 -170.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.65 -163.28 34.46 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.541 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -84.0 -31.84 25.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.753 0.311 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -59.58 -26.75 65.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.051 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.23 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.03 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 13.0 mm-40 -103.28 175.25 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.966 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -84.15 134.32 34.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.857 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -95.43 165.01 12.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.969 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 9.4 pt -62.91 134.91 27.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.166 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -95.16 106.89 18.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.967 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.21 101.76 6.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.414 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.07 154.19 43.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -79.01 156.99 28.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -115.25 116.62 28.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -75.19 89.52 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.891 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.07 -73.43 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 68.13 -69.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.994 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.28 107.65 5.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -172.79 93.08 0.11 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.07 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.15 -171.29 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.061 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -60.42 94.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.862 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -104.15 -98.69 2.52 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.6 144.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.816 0.341 . . . . 0.0 111.408 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -70.59 117.73 12.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -148.87 -47.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.842 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.66 127.69 32.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.49 56.99 0.69 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.527 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.55 -137.08 13.18 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -155.91 160.68 40.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -157.08 -46.91 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.462 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.98 89.72 0.18 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.511 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -153.07 98.77 2.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.866 0.365 . . . . 0.0 110.881 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.5 31.32 3.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -166.41 109.88 0.38 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.575 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.0 p -157.66 156.4 31.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.919 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -172.05 114.85 0.54 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.477 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.67 -160.75 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.49 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.94 89.46 2.4 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.647 0.26 . . . . 0.0 110.895 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.27 165.14 27.79 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.489 2.126 . . . . 0.0 112.146 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 58.66 30.03 19.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.794 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.425 HG22 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -103.57 135.33 19.39 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.92 125.96 18.43 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.35 2.034 . . . . 0.0 112.062 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.99 163.55 22.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.088 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.3 t -73.82 154.71 39.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.423 ' HB3' ' CE3' ' A' ' 83' ' ' TRP . . . -82.55 114.65 21.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.498 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.65 -50.03 0.81 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.453 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.5 p -108.64 -179.0 3.74 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.847 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -108.0 75.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.012 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.25 132.5 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.425 ' CD2' HG22 ' A' ' 60' ' ' ILE . 9.3 p80 -63.85 134.84 55.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.422 HD13 ' CE1' ' A' ' 84' ' ' HIS . 4.7 mm -59.65 151.54 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.937 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.58 36.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -107.16 158.23 17.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -60.13 -74.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.6 121.15 24.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.995 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.2 mm -124.86 151.49 30.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.205 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 mp -109.74 106.98 16.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.392 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -90.75 124.38 35.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.04 159.9 35.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.13 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 58.31 36.44 25.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.44 32.7 16.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.04 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 mtm-85 -170.02 169.93 7.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.419 ' CD2' HG13 ' A' ' 70' ' ' ILE . 21.4 p-80 -86.42 127.41 34.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.423 ' CE3' ' HB3' ' A' ' 64' ' ' ALA . 53.5 m95 -119.81 123.71 44.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.8 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.422 ' CE1' HD13 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.78 172.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.992 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -77.11 -47.8 19.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.855 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -85.91 -25.81 25.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 84.5 m -73.82 -28.2 61.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 15.9 tp -80.79 90.17 5.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.002 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -143.71 154.83 43.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 8.4 t -59.85 147.06 39.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.847 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.4 m -73.51 -28.78 62.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.154 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -101.43 -63.05 1.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.189 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 30.0 m -59.83 -29.8 68.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.106 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.66 22.72 8.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.015 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -84.81 156.47 61.2 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.138 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.98 5.92 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.534 2.156 . . . . 0.0 112.366 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.1 mp -104.88 61.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.828 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.32 40.51 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -151.7 -46.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -148.23 143.61 27.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.725 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.3 t -119.16 156.05 30.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.99 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.428 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -154.82 119.97 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.775 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 1.2 t -96.73 160.53 14.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.996 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.448 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 0.0 OUTLIER -164.67 123.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.52 -131.86 51.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -98.85 31.62 2.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.885 0.374 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.3 m -162.66 173.73 13.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.797 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 13.8 p -102.15 115.86 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.35 120.94 36.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.857 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.1 p -60.33 172.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.13 -32.19 50.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.773 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.428 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -51.74 -57.99 7.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.424 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -74.15 -20.67 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.478 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 t80 -62.19 -26.36 68.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.94 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.428 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 3.7 m-85 -78.97 -39.61 33.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.036 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -85.04 -51.03 6.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.253 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 -73.35 -51.35 17.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.448 ' CE2' ' CD ' ' A' ' 104' ' ' ARG . 5.1 m-85 -102.79 37.04 2.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.108 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.65 162.96 32.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.449 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 74.8 m -58.76 152.16 19.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.761 0.315 . . . . 0.0 110.959 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 126' ' ' GLN . 0.1 OUTLIER -169.01 147.88 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 38.0 t -65.44 130.84 44.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.922 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -95.67 23.45 6.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -41.61 2.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.978 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.9 m -106.94 -12.9 15.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.293 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER 63.95 30.27 14.23 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 0.0 110.784 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -106.61 137.65 44.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.61 102.28 0.8 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.646 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.447 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 6.7 mt -60.26 140.38 91.39 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.493 0.187 . . . . 0.0 110.801 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.592 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 84.1 Cg_exo -47.34 173.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.468 2.112 . . . . 0.0 112.31 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.402 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 63.5 Cg_endo -77.39 -54.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.47 2.113 . . . . 0.0 113.85 -179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.88 21.59 10.63 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.592 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 2.1 pt20 -59.02 140.01 56.21 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.512 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -80.12 108.74 13.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.934 0.397 . . . . 0.0 110.727 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.2 p -154.64 158.91 3.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.218 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -96.91 137.98 35.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.653 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.85 131.09 54.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.768 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -59.76 96.53 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.662 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 54.03 -86.47 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.391 0.615 . . . . 0.0 111.61 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.9 m-20 -99.42 -48.47 4.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -80.63 166.59 20.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.585 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.7 p -127.15 157.24 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.647 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' A' ' 169' ' ' SER . 22.7 m-85 -153.58 161.79 41.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.4 . . . . 0.0 111.324 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.419 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 77.0 m80 -60.62 145.4 49.15 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.308 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -17.95 65.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -81.94 -49.02 10.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.946 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 15.1 p -81.06 -29.87 34.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.172 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.431 ' CZ ' HD23 ' A' ' 171' ' ' LEU . 20.0 t80 -63.08 99.07 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.84 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -162.0 175.28 11.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.098 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 47.1 t -78.72 150.21 32.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . 0.401 ' CG1' ' NH1' ' A' ' 170' ' ' ARG . 34.5 m -72.26 -39.82 64.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.419 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.45 -57.23 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.549 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 35.2 m -65.89 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.9 34.36 23.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 54.0 mtm-85 -128.98 151.41 49.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -75.71 150.42 37.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.948 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.2 mm? -100.88 171.49 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.811 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.03 167.18 23.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.938 0.399 . . . . 0.0 111.275 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.2 m -43.27 129.14 4.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.644 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.19 -22.94 33.95 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.828 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -67.94 129.03 38.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.86 0.362 . . . . 0.0 110.81 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -88.02 123.64 32.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.033 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.448 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 7.3 p90 -141.45 162.39 35.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.072 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 50.9 m-85 -110.93 171.03 7.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.908 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -131.77 110.97 11.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.9 mmt -73.53 -89.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.137 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -83.2 -49.2 9.69 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.84 0.352 . . . . 0.0 110.963 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -173.91 -59.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.675 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.427 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . 32.8 t -93.3 -22.99 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.401 ' NH1' ' CG1' ' A' ' 151' ' ' VAL . 2.9 mmm180 -56.41 102.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.13 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -91.51 125.77 36.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.826 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 11.8 p -145.03 123.36 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.066 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 5.1 m -66.76 -172.44 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.056 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 1.4 mtpm? -86.08 -35.99 19.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.776 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.59 67.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.091 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.07 4.09 35.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.457 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 21.7 t80 -62.01 -65.98 0.61 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.059 0.457 . . . . 0.0 110.978 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -47.02 -28.63 1.74 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.492 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -30.57 57.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.975 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.06 -20.78 17.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.526 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.46 -178.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.816 -179.985 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.8 p . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.831 0.348 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 p -66.36 131.5 46.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.87 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -131.31 123.25 27.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.907 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.3 m -154.75 84.18 3.84 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.095 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.71 -43.3 1.93 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.589 2.193 . . . . 0.0 112.293 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -157.55 54.26 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HB ' ' CZ ' ' A' ' 164' ' ' TYR . 14.6 p -124.45 159.48 30.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.256 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.27 -165.37 1.01 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.363 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 p -155.06 144.7 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 0.0 111.369 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.427 HG21 ' CE1' ' A' ' 163' ' ' PHE . 47.8 t -62.06 146.1 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.169 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.68 -159.37 10.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.949 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -68.2 132.83 91.64 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.481 0.181 . . . . 0.0 110.9 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -65.25 145.15 83.25 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.343 2.029 . . . . 0.0 112.567 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.06 142.97 5.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.226 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 0.7 OUTLIER -124.22 173.67 8.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.942 0.401 . . . . 0.0 111.28 -179.544 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -39.17 69.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.132 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.476 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 53.04 82.32 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.6 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.31 -51.31 0.25 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.532 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 62.45 -176.09 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 0.0 110.8 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.487 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -156.42 -75.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.64 144.73 14.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.596 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.41 -30.97 29.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.02 -25.9 63.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.223 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -55.99 -68.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.131 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' ' CZ ' ' A' ' 102' ' ' PHE . 3.1 tp10 -75.64 173.45 11.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.02 100.0 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.852 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tp -77.22 159.0 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.038 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.95 127.58 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 m -88.11 106.84 18.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.799 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.08 101.83 11.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.09 153.37 40.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.991 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -82.2 157.0 24.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -111.39 113.85 26.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.925 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.8 t -70.68 84.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -137.31 -74.77 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.955 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.97 -70.08 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.39 105.61 17.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.923 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.27 -46.63 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.081 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.96 17.49 5.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.445 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 60.75 79.75 0.24 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.54 -29.9 76.25 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.511 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.64 153.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.822 0.344 . . . . 0.0 111.388 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -78.68 -62.15 1.78 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.25 129.12 54.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.54 163.34 12.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.911 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.48 -115.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.43 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -137.56 63.22 0.57 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.514 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.5 t -156.91 87.42 1.0 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.92 -32.5 0.16 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.509 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.67 -93.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.502 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -93.73 89.25 6.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.831 0.348 . . . . 0.0 110.923 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.6 mtt -131.42 161.32 32.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.877 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 136.25 -74.21 0.42 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.474 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.4 m -106.65 131.91 53.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.869 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.49 134.0 7.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.454 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -105.1 -160.67 23.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.494 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.14 141.2 40.02 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.663 0.268 . . . . 0.0 110.897 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.78 164.51 35.37 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.443 2.095 . . . . 0.0 112.262 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 57.09 28.51 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.448 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -96.83 135.03 22.35 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -58.55 125.94 19.86 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.431 2.087 . . . . 0.0 111.994 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 136.14 33.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -58.24 164.17 2.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.904 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.452 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -89.48 114.63 26.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.37 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 128.05 -68.37 0.54 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.538 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 11.7 p -108.43 141.98 39.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.51 83.91 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.015 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 179.57 126.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.448 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 22.8 p80 -63.9 168.2 5.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.909 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -106.32 160.13 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.097 0.475 . . . . 0.0 110.818 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.21 35.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.292 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -99.24 -178.61 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.847 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -72.76 0.22 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -83.67 144.14 29.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.0 mm -145.44 146.91 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.993 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -108.63 106.81 17.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.412 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -91.05 134.73 34.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -167.6 164.28 14.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 58.88 37.46 24.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.08 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.61 28.79 17.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -166.03 176.14 7.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 21.8 p-80 -94.09 128.8 40.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.452 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 42.2 m95 -119.64 133.2 55.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.725 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 171.72 0.27 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 t -80.05 -39.76 29.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.3 pttt -90.95 -29.08 17.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.13 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -67.65 -30.76 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.953 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.43 75.8 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.888 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -120.73 136.82 54.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.841 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.26 135.3 57.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.4 m -80.1 -0.89 37.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.681 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 6.3 t0 -107.78 -63.02 1.36 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.716 0.293 . . . . 0.0 111.356 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 30.2 p -94.14 -21.09 19.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.456 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 59.11 39.76 22.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.9 0.381 . . . . 0.0 110.853 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 22.0 t -107.84 129.71 23.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.1 118.89 3.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.568 2.179 . . . . 0.0 112.479 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.5 mp -85.18 -75.39 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.75 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 57.38 31.82 20.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.238 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -156.45 -75.91 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.4 130.44 55.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.957 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.95 128.0 51.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.931 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.422 ' CZ ' ' HG2' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -114.72 155.82 25.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.851 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.9 t -133.21 136.19 45.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.987 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -153.91 123.95 6.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.72 -60.58 4.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -176.54 -43.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 0.0 110.937 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 12.9 m -73.35 -170.77 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.0 p -113.03 122.91 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.06 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.418 ' CZ ' ' HB2' ' A' ' 92' ' ' ASP . 2.0 m-85 -119.26 155.79 31.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -102.39 149.24 24.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.706 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 2.5 mtmp? -54.57 -40.04 68.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.194 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -59.12 -29.53 67.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.923 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -84.12 -29.75 26.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.487 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 14.3 t80 -64.94 -30.22 71.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 3.5 m-85 -77.21 -41.22 42.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -81.35 -28.01 34.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 38.3 mmt180 -96.04 -55.47 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.22 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.43 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 12.4 m-85 -104.08 29.66 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.195 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.73 -151.14 5.7 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.278 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.7 m -103.01 153.49 20.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.8 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -144.85 -164.99 2.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.958 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 32.4 t -116.5 139.05 50.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.958 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -104.96 24.97 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.28 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.13 -53.13 1.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.976 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.21 -16.57 13.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.247 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 71.14 79.45 0.17 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.831 0.348 . . . . 0.0 111.01 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.425 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.4 OUTLIER -156.72 133.82 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.646 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.34 99.83 0.11 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.726 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.483 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 59.0 mt -62.49 141.54 96.62 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.548 0.214 . . . . 0.0 110.769 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.539 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 78.6 Cg_exo -42.83 168.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.736 2.291 . . . . 0.0 112.772 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -77.14 -55.64 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.926 2.417 . . . . 0.0 114.737 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.476 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 2.0 m -126.43 21.96 7.13 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -177.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.539 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 71.2 mm-40 -58.17 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.322 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -129.13 108.61 17.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.738 0.304 . . . . 0.0 111.112 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 13.4 p -143.49 157.68 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.74 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.48 134.96 39.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.064 0.459 . . . . 0.0 111.252 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.0 172.97 6.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.528 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -146.31 168.97 19.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.229 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.468 ' HG2' ' C ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER 40.73 -83.82 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.55 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' A' ' 138' ' ' ALA . 21.7 t0 -162.09 38.12 0.12 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.732 0.301 . . . . 0.0 111.19 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -153.43 157.17 39.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.698 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.67 153.18 11.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.668 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -143.47 147.54 34.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.023 0.44 . . . . 0.0 111.35 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 77.8 m80 -57.84 143.68 41.52 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.37 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -17.93 64.87 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 176.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -82.53 -41.06 20.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.222 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.41 -25.79 20.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.636 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.452 ' CE1' ' CD2' ' A' ' 171' ' ' LEU . 2.1 t80 -60.54 91.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.84 0.352 . . . . 0.0 110.657 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -167.78 174.25 7.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.12 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 49.5 t -76.23 150.25 37.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . 0.401 ' CG1' ' CG ' ' A' ' 170' ' ' ARG . 6.4 m -74.89 -35.56 36.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.345 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -88.75 -57.55 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.412 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.8 m -65.86 -28.09 68.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.157 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt 60.31 38.72 19.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.4 ttm-85 -128.96 145.14 51.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.028 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -78.29 155.94 29.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.028 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.457 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -106.46 168.72 8.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.675 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 166.94 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.315 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.5 m -43.37 122.04 2.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.539 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.73 -23.94 31.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.614 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -77.29 129.0 35.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.848 0.356 . . . . 0.0 110.88 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -87.98 121.65 30.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.941 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.448 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 17.8 p90 -131.07 179.04 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.435 ' CZ ' ' HB ' ' A' ' 7' ' ' VAL . 0.7 OUTLIER -132.63 114.91 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.525 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . 0.44 HD12 ' CG ' ' A' ' 139' ' ' GLN . 7.7 tt -93.73 110.81 22.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 0.0 110.51 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.19 159.95 33.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.76 -25.57 7.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.89 27.61 3.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.188 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 5.0 m 55.45 31.19 16.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.024 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 14.9 ttm180 -94.72 102.84 14.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.452 ' CD2' ' CE1' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -66.97 126.77 30.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.898 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . 0.415 HG13 ' CD1' ' A' ' 177' ' ' TYR . 8.6 p -145.34 140.73 22.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.711 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.9 155.09 23.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.775 0.321 . . . . 0.0 110.963 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.416 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 8.7 mtmt -60.51 -30.16 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.769 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.35 -59.07 5.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.272 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.39 -0.18 40.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.404 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.425 ' CZ ' ' HE2' ' A' ' 181' ' ' LYS . 8.7 t80 -61.67 -65.74 0.64 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.939 0.399 . . . . 0.0 110.657 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -57.21 -26.77 61.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.128 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 59.0 m -75.4 -22.84 57.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.339 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.19 12.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . 0.425 ' HE2' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER -171.93 -177.27 1.89 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.866 179.892 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.4 p . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.842 0.354 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 t -100.48 -46.96 5.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tm0? 62.37 149.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.5 m -118.4 82.64 19.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.088 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 166.11 29.39 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.625 2.217 . . . . 0.0 112.298 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 60.25 81.01 0.19 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.922 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 p -125.96 158.63 35.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.42 ' HE2' ' CZ ' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -129.42 -175.04 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.723 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.6 p -154.98 134.48 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.16 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.434 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.0 t -58.15 146.12 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.46 -169.35 12.6 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.482 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -60.35 146.19 84.78 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.565 0.221 . . . . 0.0 110.687 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -77.89 129.96 10.18 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.57 2.18 . . . . 0.0 112.238 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.75 154.61 35.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.441 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.459 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -138.73 173.72 11.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.143 0.497 . . . . 0.0 111.555 -179.631 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -50.57 32.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 59.46 96.1 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.76 -66.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.562 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 60.79 95.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' CE1' ' A' ' 115' ' ' PHE . 11.0 p90 -58.71 -32.6 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.67 129.88 2.71 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.491 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -58.01 -28.38 64.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.737 0.304 . . . . 0.0 111.124 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -64.48 -51.13 64.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.114 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.43 -36.44 71.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.076 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.432 ' HG3' ' CE2' ' A' ' 102' ' ' PHE . 31.3 mm-40 -72.74 176.03 5.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.83 100.0 4.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.808 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.4 144.03 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.95 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.8 pt -63.01 148.15 11.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -118.02 106.88 13.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -77.23 101.86 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.642 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.49 160.22 40.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.018 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -74.3 119.63 18.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -59.45 -28.41 66.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.011 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m 63.48 34.14 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -130.53 76.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -98.66 31.41 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.924 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -152.15 78.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -156.42 -45.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.095 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -150.79 169.89 20.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.104 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -60.31 90.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.21 -154.1 25.77 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.509 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.8 tp -52.25 -44.97 43.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.863 0.363 . . . . 0.0 111.519 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -60.78 149.88 34.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -133.05 129.94 38.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.855 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -79.98 -34.36 38.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.48 -46.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.503 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -153.24 140.16 7.4 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.487 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.9 p -176.25 -41.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.839 0.352 . . . . 0.0 110.864 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.23 -170.74 33.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.507 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.48 50.22 1.28 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.53 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -152.73 -178.47 6.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.31 . . . . 0.0 110.934 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.5 tpt -84.69 149.44 25.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 160.06 -31.43 0.4 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.52 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.9 m -107.18 -31.23 8.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.883 0.373 . . . . 0.0 110.951 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -64.11 -133.2 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.501 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.0 75.01 1.28 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.514 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.98 87.53 51.42 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.757 0.313 . . . . 0.0 110.929 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -51.58 164.68 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.524 2.149 . . . . 0.0 112.334 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 59.24 31.36 21.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.428 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.3 tp -109.97 134.91 20.55 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.94 125.91 18.29 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.422 2.081 . . . . 0.0 112.122 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.59 140.6 29.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.074 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.8 164.29 2.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -85.83 114.63 22.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.33 -73.03 0.38 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.613 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -100.26 153.63 19.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.822 0.344 . . . . 0.0 111.004 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.08 86.51 2.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.03 133.6 0.12 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.428 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.4 p80 -70.55 161.0 31.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.42 HD11 ' CD2' ' A' ' 84' ' ' HIS . 9.6 mm -94.5 153.67 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.401 ' CD2' ' ND1' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -161.13 29.99 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.925 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.12 170.27 7.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -74.18 0.33 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.673 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.94 91.7 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.661 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -104.95 140.79 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.6 mp -89.87 106.9 18.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.584 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -90.77 115.02 27.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -156.5 156.78 34.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.275 -179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.69 36.34 16.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.056 180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.18 29.9 17.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -168.21 -178.45 3.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 26.2 p-80 -100.11 125.29 46.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.443 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 37.0 m95 -114.34 132.82 56.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.826 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.64 172.2 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.12 -40.12 28.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -91.0 -29.78 17.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.22 -30.92 70.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.7 tp -72.29 77.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -135.6 165.72 24.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.78 138.44 41.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.84 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -29.58 68.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.914 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -105.08 -59.79 1.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -61.43 -39.9 92.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 58.48 22.29 9.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.02 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.6 m -85.78 156.25 58.46 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.219 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -59.66 118.9 5.84 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.607 2.205 . . . . 0.0 112.159 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -112.96 54.89 0.71 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.712 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.76 30.21 3.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.138 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -141.48 -47.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.85 135.7 38.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.5 t -121.44 170.94 9.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.502 ' CZ ' ' CD2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -176.97 120.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.609 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t -131.72 157.72 43.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.876 0.37 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -170.22 124.0 0.72 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.887 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 -94.27 1.96 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.497 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -147.87 36.01 0.85 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.801 0.334 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.6 m -159.42 -176.88 6.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -136.3 116.19 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.129 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -110.47 166.87 10.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 22.6 p -90.83 168.07 11.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.685 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.4 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 0.1 OUTLIER -56.35 -44.92 80.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.962 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.421 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 12.2 t70 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -77.82 -21.0 52.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.35 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.502 ' CD2' ' CZ ' ' A' ' 102' ' ' PHE . 11.6 t80 -67.99 -44.08 77.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.368 . . . . 0.0 110.891 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 18.1 m-85 -60.67 -41.4 95.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -81.27 -30.43 34.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.351 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -80.96 -54.05 5.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.288 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -105.58 -43.09 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.104 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.53 164.71 11.28 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.487 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 85.8 m -60.72 155.08 19.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.774 0.321 . . . . 0.0 110.719 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -140.28 172.51 12.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.07 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.6 t -85.34 130.57 34.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.17 28.42 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.144 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.443 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.16 -53.76 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.78 -16.09 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.234 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.8 71.74 0.42 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.898 0.38 . . . . 0.0 110.81 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.417 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -128.09 -164.57 1.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -104.72 107.03 2.82 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.721 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.459 ' CG2' HD11 ' A' ' 15' ' ' LEU . 8.5 mt -87.89 127.35 58.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.4 0.143 . . . . 0.0 110.622 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.585 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 52.1 Cg_exo -53.14 177.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.241 1.96 . . . . 0.0 112.316 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.23 -49.16 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.082 2.522 . . . . 0.0 113.554 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.6 m -126.07 21.9 7.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.585 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -53.35 -175.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.328 . . . . 0.0 110.692 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -125.48 109.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 111.069 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.5 p -156.95 160.34 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.133 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.87 138.13 34.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.652 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -104.91 136.01 45.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.979 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.43 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . . . -74.83 96.65 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 54.38 -87.16 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.087 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -96.88 -48.17 5.55 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.823 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -84.4 163.01 19.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.644 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.9 p -108.62 151.31 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.708 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.443 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 13.7 m-85 -129.01 170.21 13.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.945 0.403 . . . . 0.0 111.299 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 37.7 m80 -97.56 140.19 32.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.955 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.07 -21.26 44.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -91.13 -38.66 12.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.306 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -98.73 12.45 35.48 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.449 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 53.5 t80 -101.56 101.63 12.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -158.94 177.76 10.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 45.2 t -86.48 150.18 24.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 27.6 m -72.17 -36.69 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.317 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -88.4 -56.94 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.498 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.6 m -65.87 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.159 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? 59.66 32.84 21.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.943 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -128.97 153.01 47.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.03 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -72.16 174.54 7.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.467 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -128.12 173.31 10.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.847 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 163.51 35.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.963 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.2 t -46.8 129.36 11.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.245 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 101.85 -25.31 28.38 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.464 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -70.45 129.18 38.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.821 0.343 . . . . 0.0 110.779 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.95 122.0 31.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.04 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.438 ' CE2' HD21 ' A' ' 171' ' ' LEU . 5.4 p90 -139.25 155.45 47.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.955 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.451 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 34.4 m-85 -103.02 171.08 7.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.612 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -130.3 114.46 15.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.4 mmt -70.73 -178.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.11 -28.71 60.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -97.58 28.96 3.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.057 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.07 43.63 24.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.021 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.72 124.09 45.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -74.66 120.83 20.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.5 p -145.3 127.39 9.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.1 m -72.34 -173.19 1.05 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.889 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.413 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 12.7 mttt -85.94 -32.24 21.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.84 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.42 -52.33 54.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.15 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -85.21 3.98 36.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.429 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.451 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.6 t80 -59.17 -66.05 0.57 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.964 0.411 . . . . 0.0 110.763 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.32 -27.89 57.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 85.9 m -77.83 -35.43 51.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.11 4.04 51.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.579 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.3 -177.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 110.862 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.914 179.977 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.828 0.347 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m 60.4 31.5 20.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 60.75 111.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.951 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.9 m -126.69 82.79 66.48 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.085 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.33 -42.69 2.63 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.535 2.157 . . . . 0.0 112.31 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -141.76 87.8 2.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.0 p -121.77 158.6 25.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.07 -177.12 5.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.69 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.4 p -154.97 135.09 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.141 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG21 ' CE1' ' A' ' 163' ' ' PHE . 47.9 t -59.27 146.17 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.63 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.88 -169.11 11.98 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.482 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.4 mm-40 -56.3 135.5 75.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.549 0.214 . . . . 0.0 110.744 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 17.2 Cg_exo -64.54 135.62 46.54 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.382 2.054 . . . . 0.0 112.385 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -162.94 147.69 11.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.544 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.419 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 1.0 OUTLIER -117.77 173.35 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.109 0.48 . . . . 0.0 111.285 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -36.24 78.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.4 ' CA ' ' CG2' ' A' ' 132' ' ' THR . . . 57.66 74.88 0.29 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.09 -60.96 0.48 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.478 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 62.61 97.68 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.494 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -59.22 -166.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.899 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.43 147.44 19.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -84.03 -35.74 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.98 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -89.5 7.12 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.18 -31.22 34.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 33.4 tp10 -109.66 164.25 12.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -75.97 99.96 4.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.951 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tp -79.72 165.07 23.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.6 pt -62.89 164.16 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.5 m -126.82 107.07 9.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.774 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.99 101.78 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.547 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.09 151.26 36.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.952 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -82.04 156.97 24.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -115.7 144.44 43.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 p -96.85 40.02 1.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.53 -70.29 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 63.7 -79.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.007 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -69.82 -75.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 64.68 -78.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.132 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -165.62 108.63 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 60.71 32.5 20.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.74 -29.84 68.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.484 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.7 mm -82.3 104.06 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 110.943 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.34 87.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.22 -46.69 0.92 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -65.03 118.3 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.89 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.69 122.66 2.66 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 113.4 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.489 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 t -133.46 177.89 7.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.867 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.88 46.3 3.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.487 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.45 28.45 2.88 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.514 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -165.39 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 110.936 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -176.4 -44.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 136.19 143.89 4.76 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.483 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -87.55 -74.65 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.757 0.313 . . . . 0.0 110.844 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.52 132.6 3.27 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.501 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -103.04 -163.02 25.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.462 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.03 82.97 1.21 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.0 110.965 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.45 169.0 18.09 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.534 2.156 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 58.41 29.09 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.834 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.422 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.2 tp -99.49 135.5 20.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -56.39 125.93 20.65 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.407 2.071 . . . . 0.0 112.047 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.12 137.94 31.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.3 p -58.37 164.22 2.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.881 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -87.25 114.63 24.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.27 -71.48 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.66 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.5 p -103.48 155.68 18.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.37 88.3 3.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.112 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -178.44 136.62 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.422 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.8 p80 -73.67 157.13 37.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.009 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 3.9 mm -88.77 151.55 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.92 37.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.019 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -103.36 179.91 4.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -39.8 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.713 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -109.21 110.22 21.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -120.0 154.79 22.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.389 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.53 107.06 15.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.093 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.7 119.0 30.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -153.01 162.71 41.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.148 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 57.01 36.32 27.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 62.54 30.38 17.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.009 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 21.0 mtt180 -164.2 -178.99 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.015 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 32.9 p-80 -98.8 121.24 40.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.022 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.449 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 46.1 m95 -112.48 130.46 55.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.39 171.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.881 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -79.93 -41.08 26.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.991 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -89.77 -28.61 19.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.016 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.83 -30.78 68.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 8.1 tp -72.14 80.39 0.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.057 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mmtt -144.63 141.12 29.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.914 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 11.6 t -59.8 132.45 54.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.1 m -77.85 -4.3 45.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.504 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -111.31 -31.8 6.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.065 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 14.1 m -111.87 -30.48 7.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.149 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 9.9 t-160 60.77 25.26 15.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.944 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 3.5 m -85.27 159.84 55.61 Favored Pre-proline 0 N--CA 1.453 -0.299 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.213 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -59.9 121.2 9.45 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.685 2.257 . . . . 0.0 112.312 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -124.55 30.48 5.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.698 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.49 61.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.555 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -92.04 -39.9 11.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.994 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -140.17 170.74 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.893 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.3 t -150.89 156.16 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.429 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.8 t80 -157.94 119.91 3.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.79 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.8 t -130.83 162.27 29.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 4.2 mmm-85 -153.63 124.04 7.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.77 -78.54 0.74 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -133.91 -74.29 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.778 0.323 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 m -59.8 164.66 3.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.3 p -107.3 115.93 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.65 120.89 39.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.799 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 27.3 p -60.09 170.51 1.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.429 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.11 -31.88 50.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.196 -179.739 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -50.82 -58.01 7.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.438 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.53 -20.97 58.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.494 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 9.5 t80 -60.14 -26.97 66.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.675 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -79.28 -44.3 21.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.956 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -85.29 -62.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.721 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.05 -50.77 72.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.78 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -88.29 -43.03 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.684 0.278 . . . . 0.0 111.362 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.76 -168.36 36.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.432 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 24.3 m -58.95 148.69 29.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -151.38 162.22 41.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.5 t -79.83 127.6 32.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.943 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.55 30.67 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.419 ' HB1' ' CD2' ' A' ' 143' ' ' TYR . . . -124.99 -56.39 1.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.058 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.74 -22.43 11.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.11 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 71.47 73.22 0.18 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.957 0.408 . . . . 0.0 110.912 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.424 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -128.53 -164.54 1.39 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.807 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -109.38 106.11 2.16 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.616 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.405 ' CG2' HD13 ' A' ' 15' ' ' LEU . 2.4 mt -94.97 128.02 40.75 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.448 0.166 . . . . 0.0 110.657 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.59 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.7 Cg_exo -52.25 175.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.196 1.931 . . . . 0.0 112.197 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.37 -47.3 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.646 2.23 . . . . 0.0 113.871 -179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.4 ' CG2' ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.53 21.91 7.73 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.177 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.59 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -56.73 -170.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.594 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.15 108.66 23.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.751 0.31 . . . . 0.0 110.544 179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 10.2 p -157.19 161.72 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.167 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.71 135.06 39.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.246 179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 144.43 43.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.088 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -84.45 96.67 9.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.44 -89.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.529 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.1 m-20 -84.61 -44.5 13.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.749 -177.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.419 ' CE1' ' HB3' ' A' ' 169' ' ' SER . 7.2 m-85 -91.64 167.21 12.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.473 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.3 p -124.61 119.78 57.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.901 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.419 ' CD2' ' HB1' ' A' ' 124' ' ' ALA . 6.0 m-85 -102.98 138.7 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.424 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 64.4 m80 -60.82 141.27 57.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -18.79 60.23 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -88.24 -36.7 16.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.912 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.9 OUTLIER -100.89 21.27 13.94 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.447 -179.676 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.446 ' CE1' ' CD2' ' A' ' 171' ' ' LEU . 5.6 t80 -89.8 109.75 20.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.841 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.08 157.71 4.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.959 0.409 . . . . 0.0 111.259 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.16 150.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 10.8 m -91.09 22.47 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.508 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 39.2 t -136.74 -62.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.813 0.339 . . . . 0.0 110.618 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.9 p -85.02 -20.83 29.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.653 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 65.01 61.75 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.193 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -129.13 137.58 51.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.071 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -68.17 154.06 42.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.176 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.462 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.4 OUTLIER -122.68 147.1 46.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.64 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -127.54 165.89 19.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.0 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -46.05 128.2 9.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.206 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.17 -26.67 22.24 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.82 128.96 37.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.813 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -87.99 118.84 27.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.035 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.437 ' CE1' HG21 ' A' ' 10' ' ' VAL . 6.2 p90 -135.63 151.28 50.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 26.0 m-85 -97.06 171.01 8.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.795 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 2.8 tp -132.22 118.39 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.782 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.7 mmt -56.38 164.26 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -58.2 -30.46 66.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.159 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.92 -79.04 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.994 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 141' ' ' PHE . 36.5 p 178.99 77.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.804 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -144.5 119.38 9.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.446 ' CD2' ' CE1' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -66.92 121.43 15.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.841 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -139.09 140.76 37.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.001 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.31 160.99 14.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HG3' ' CE2' ' A' ' 164' ' ' TYR . 9.4 mttp -58.12 -46.84 84.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.136 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.35 -27.15 62.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.308 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -104.07 -6.87 20.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.447 ' CE2' ' CB ' ' A' ' 182' ' ' GLN . 8.3 t80 -56.2 -66.04 0.5 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.843 0.354 . . . . 0.0 110.986 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.6 -31.37 72.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.928 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -31.5 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.873 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -78.29 -52.02 9.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.13 -67.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.947 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . 0.447 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.922 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.85 0.357 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -134.65 88.82 2.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -131.87 36.79 3.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.2 m -138.56 149.84 64.0 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.09 -168.03 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.92 103.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.429 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 14.2 p -123.96 158.87 29.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.189 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -140.95 179.18 6.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.716 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.3 p -155.11 133.81 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.445 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.1 t -54.8 146.31 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.662 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -143.23 -140.76 3.73 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.702 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -72.96 117.04 56.47 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.527 0.204 . . . . 0.0 110.865 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -65.03 137.51 52.87 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.388 2.059 . . . . 0.0 112.115 179.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.05 153.96 16.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.787 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 1.0 OUTLIER -124.86 173.47 8.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.109 0.481 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -28.42 68.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.692 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 55.35 61.05 7.82 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.527 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.65 -67.13 1.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.545 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 65.92 67.72 0.47 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.946 0.403 . . . . 0.0 110.739 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -75.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.03 153.8 30.59 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.06 -34.19 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -62.05 -31.17 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -68.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HB3' ' CD1' ' A' ' 102' ' ' PHE . 67.5 mm-40 -65.1 175.99 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 119.05 19.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tp -103.68 165.05 11.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.9 pt -62.88 146.89 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.168 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.6 m -113.62 106.86 15.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -77.61 101.83 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.59 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.05 166.06 26.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.961 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.43 157.03 23.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.1 -29.1 9.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.885 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.71 36.84 13.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.915 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -133.83 77.45 1.71 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.416 ' CZ ' ' HB2' ' A' ' 73' ' ' ARG . 47.1 m-85 -80.62 -74.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.87 86.43 4.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.2 -68.57 0.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.061 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.15 17.45 2.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.447 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -168.98 -47.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.845 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.7 -143.81 23.71 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.55 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.421 ' N ' ' CD1' ' A' ' 42' ' ' ILE . 2.6 mp -84.24 -70.93 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.802 0.334 . . . . 0.0 110.876 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.28 128.62 37.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -103.14 174.7 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.957 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.65 -59.18 3.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.62 179.65 26.84 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.546 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.84 -152.84 17.41 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.458 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -147.93 -178.87 6.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.876 0.369 . . . . 0.0 110.929 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.87 -73.11 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.468 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.05 -30.73 2.23 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.463 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -143.54 -178.37 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.785 0.326 . . . . 0.0 110.888 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -138.33 141.17 39.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.92 84.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.49 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 p -168.39 33.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.881 0.372 . . . . 0.0 110.89 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.8 168.34 11.51 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.469 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 148.55 -160.69 28.45 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.547 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -115.61 83.01 10.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.655 0.264 . . . . 0.0 110.835 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.95 165.86 1.09 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.522 2.148 . . . . 0.0 112.173 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 58.3 30.56 19.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.833 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.421 HG23 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -107.45 135.22 19.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.991 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.27 125.9 17.37 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.359 2.04 . . . . 0.0 112.021 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.79 150.69 22.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 66' ' ' CYS . 7.7 t -58.52 140.51 53.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.711 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -62.1 114.85 3.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.71 28.77 45.62 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.98 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.402 ' CB ' ' HB3' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -135.65 -178.9 5.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.876 0.369 . . . . 0.0 110.849 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.6 -28.35 10.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.52 -167.58 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.421 ' CD2' HG23 ' A' ' 60' ' ' ILE . 6.2 p80 -107.54 171.76 7.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.971 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 10.4 mm -91.57 153.48 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.059 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -161.13 29.84 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.826 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -100.36 -178.9 3.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.926 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 36' ' ' PHE . 15.2 tpt180 -86.88 -70.11 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.986 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -81.35 105.66 12.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.111 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 1.3 mp -113.12 153.8 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.825 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.6 mp -104.79 111.95 24.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.797 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -90.95 139.03 31.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.982 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -176.7 150.59 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.119 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 58.64 37.26 25.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 62.09 30.35 17.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.111 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -166.33 167.97 15.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.895 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -92.45 117.96 30.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.449 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 69.3 m95 -105.73 125.13 50.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.67 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 175.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.955 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t -77.29 -42.08 38.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.898 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 ttpm? -91.14 -34.09 15.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 30.6 m -67.48 -28.2 67.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 48.7 tp -72.8 89.18 1.35 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.908 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.3 mttt -152.93 155.94 37.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -59.9 146.97 40.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 m -73.1 -30.98 64.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 -60.51 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.96 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 35.2 m -59.73 -34.25 72.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.962 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 57.77 22.25 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.097 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -85.18 156.33 60.13 Favored Pre-proline 0 N--CA 1.453 -0.284 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.071 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.38 118.97 6.0 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.471 2.114 . . . . 0.0 112.253 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.2 mp -111.43 60.8 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.85 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.68 36.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.081 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -153.42 -46.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.881 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.4 138.57 52.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.919 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -131.06 156.97 44.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.424 ' CD1' ' HB3' ' A' ' 25' ' ' GLU . 13.5 t80 -169.08 119.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.7 t -97.27 153.18 18.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.417 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -176.71 124.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.871 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.89 41.07 24.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 59.52 31.4 20.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.857 0.361 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.6 m -161.62 165.79 27.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.858 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.7 p -85.47 115.99 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.058 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -125.63 120.93 32.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.935 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.1 p -69.9 163.61 25.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -78.14 -24.96 47.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.353 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.426 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -55.56 -58.16 8.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 111.284 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -73.32 -20.75 60.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.254 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.424 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 32.9 t80 -61.98 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.426 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.7 m-85 -72.88 -44.79 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -79.89 -31.85 40.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.055 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -57.84 2.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.062 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.424 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 23.8 m-85 -99.04 31.13 3.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.973 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.14 169.06 32.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.404 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 86.2 m -59.78 153.56 20.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.765 0.317 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -154.9 170.66 21.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.03 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 18.8 t -81.22 137.96 35.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.82 14.03 16.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.51 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.09 -41.54 2.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.937 0.399 . . . . 0.0 111.064 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.8 m -105.9 -20.58 13.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.095 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 64.31 29.27 13.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.746 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tp -99.58 150.02 22.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.812 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.93 96.59 0.6 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.652 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.446 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 5.2 mt -59.86 140.32 90.02 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.478 0.18 . . . . 0.0 110.678 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.61 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.6 Cg_exo -48.24 175.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.301 2.001 . . . . 0.0 112.11 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.448 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.5 Cg_endo -77.38 -55.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.365 2.043 . . . . 0.0 113.948 -179.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.36 21.72 10.23 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.61 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.9 OUTLIER -60.07 139.07 57.71 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.649 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.4 t -74.89 108.71 6.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.826 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 14.0 p -151.78 161.07 3.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.12 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.81 141.86 29.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.859 0.361 . . . . 0.0 110.591 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.87 130.03 53.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.975 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.431 ' HB1' ' CD1' ' A' ' 143' ' ' TYR . . . -82.56 96.67 8.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.739 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 55.86 -86.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.451 0.644 . . . . 0.0 111.855 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -100.23 -48.41 4.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.954 -177.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -91.34 174.67 7.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.759 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 32.5 t -121.43 150.23 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.703 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.431 ' CD1' ' HB1' ' A' ' 138' ' ' ALA . 2.6 m-85 -131.34 138.99 49.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.417 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 70.1 m80 -55.12 144.93 22.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.3 -17.85 64.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.93 -38.34 14.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.078 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.417 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.8 p -95.48 25.21 4.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.531 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.447 ' CE1' ' CD1' ' A' ' 171' ' ' LEU . 0.9 OUTLIER -104.36 112.24 25.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.8 0.333 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.03 160.59 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.123 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -59.7 150.04 28.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 6.5 m -67.31 -27.31 38.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.343 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 20.1 t -108.54 -55.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.36 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 40.3 m -66.04 -28.0 68.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.078 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt 55.21 36.78 27.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.997 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -109.8 137.79 47.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -64.02 154.42 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.0 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.458 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.4 mm? -113.79 163.85 14.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.703 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 170.92 15.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 4.4 m -44.69 123.03 3.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.501 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.92 -24.36 32.56 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.679 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -67.07 128.98 38.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -87.87 128.95 35.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.142 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.453 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 12.5 p90 -143.43 141.11 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.495 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 14.8 m-85 -97.96 171.07 8.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.796 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.5 tp -131.73 110.99 11.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.792 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 5.7 mmt -60.98 172.32 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -66.11 -30.22 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -98.21 29.18 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.44 84.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.974 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.49 129.54 13.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.447 ' CD1' ' CE1' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -73.74 126.11 29.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 11.3 p -145.06 135.75 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 29.6 p -80.29 167.23 20.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.875 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -57.54 -49.64 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.066 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.6 63.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -94.98 -15.45 23.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.261 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 7.7 t80 -55.58 -66.04 0.49 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.053 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.2 -29.5 70.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 4.3 m -72.81 -33.3 66.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.029 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.6 -30.88 15.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.201 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm 61.44 175.77 0.11 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.956 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t 60.6 158.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.863 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -102.34 -55.1 2.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.91 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.9 m -60.03 149.54 73.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.083 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.72 78.07 1.37 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.509 2.139 . . . . 0.0 112.336 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.71 106.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.872 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.425 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 14.0 p -125.84 159.28 34.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.424 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -131.53 -175.62 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.7 p -155.03 139.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.263 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG21 ' CD1' ' A' ' 163' ' ' PHE . 39.8 t -66.55 146.09 13.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.665 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.01 -167.21 12.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.49 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 11.0 mt-10 -62.58 149.84 87.63 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.628 0.251 . . . . 0.0 110.832 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.1 Cg_endo -83.01 136.08 7.86 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.848 2.365 . . . . 0.0 112.399 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.06 142.89 5.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.301 179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.423 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.9 OUTLIER -117.95 173.46 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.409 -179.639 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -44.21 92.46 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.005 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 60.13 102.45 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.436 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.12 -44.69 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.567 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 62.77 20.51 12.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.66 0.267 . . . . 0.0 110.978 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.496 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 55.54 -173.95 0.05 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.822 0.344 . . . . 0.0 111.047 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.57 152.32 16.84 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.1 -31.08 25.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.912 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -88.14 7.05 33.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.427 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.85 -67.97 0.42 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.9 tp10 -110.83 176.06 5.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.907 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 136.89 40.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mp -111.96 165.06 12.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.874 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.5 pt -62.94 135.19 27.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.122 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -99.24 106.87 19.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.741 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.64 101.83 11.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.471 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.47 163.03 35.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.986 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -86.59 150.9 23.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.931 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -98.31 -31.37 12.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.936 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 m 60.26 31.66 20.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.31 -73.09 0.49 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 73' ' ' ARG . 5.2 m-85 64.17 -78.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.983 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -74.94 111.49 10.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.09 99.74 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.57 -169.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.066 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -61.81 84.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.85 -76.05 1.24 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.463 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.7 mm -82.42 119.23 31.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.69 -176.46 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.8 114.82 17.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -103.67 81.26 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.843 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 64.06 127.26 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.4 -87.1 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.469 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.73 136.59 38.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.803 0.335 . . . . 0.0 110.962 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 145.46 45.41 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.488 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 161.33 -154.87 25.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.386 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -103.01 -36.45 8.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.92 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 7.3 mtt -75.04 168.32 20.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.02 -62.52 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.511 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 m 60.46 35.6 20.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.811 0.338 . . . . 0.0 110.889 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -154.55 163.39 31.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.16 116.33 4.15 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.547 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.24 89.52 4.79 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.667 0.27 . . . . 0.0 110.9 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.38 165.64 26.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.175 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 58.36 29.82 18.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.767 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.419 HG23 ' CD2' ' A' ' 69' ' ' HIS . 2.9 tp -103.02 135.66 19.36 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.88 125.92 19.01 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.408 2.072 . . . . 0.0 111.891 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.55 149.01 21.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.4 t -58.22 137.39 57.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.705 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' HB2' ' CZ2' ' A' ' 83' ' ' TRP . . . -61.06 114.76 3.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.266 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.47 28.38 39.91 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.914 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.54 -178.86 5.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.837 0.351 . . . . 0.0 110.96 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.9 -28.79 9.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.691 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.26 -165.94 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.703 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.419 ' CD2' HG23 ' A' ' 60' ' ' ILE . 7.4 p80 -110.76 154.56 23.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.418 HD12 ' CE1' ' A' ' 84' ' ' HIS . 5.7 mm -66.92 153.72 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.404 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.4 OUTLIER -168.83 33.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.783 -179.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -109.38 -178.97 3.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -95.13 -35.73 11.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -105.03 115.68 30.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.055 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.1 mm -133.62 153.88 37.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.229 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.9 mp -113.18 107.93 16.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.278 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -90.77 123.21 34.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.043 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.48 162.19 35.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.051 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 57.85 35.47 25.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.47 40.76 10.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.02 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.45 171.13 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -93.2 117.92 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.427 ' CZ2' ' HB2' ' A' ' 64' ' ' ALA . 73.5 m95 -109.72 125.41 52.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.791 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.418 ' CE1' HD12 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.26 176.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.957 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.01 -42.01 24.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.13 -15.56 29.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.113 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.5 m -96.74 26.16 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.734 0.302 . . . . 0.0 111.083 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.8 tp -124.06 29.55 6.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.998 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 152.21 20.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.16 147.03 52.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -66.56 -29.61 69.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.032 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -106.13 -58.38 1.92 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 17.0 m -59.92 -37.67 80.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 58.0 22.58 9.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.028 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -87.01 155.9 55.12 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.151 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.21 118.94 5.75 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.513 2.142 . . . . 0.0 112.339 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -101.81 70.69 1.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.89 35.19 1.75 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.108 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.2 mm-40 -152.42 -48.51 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.889 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -149.41 157.76 43.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.909 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 20.0 t -157.02 128.0 6.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.953 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.421 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.9 m-85 -98.45 171.96 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.59 140.43 17.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.874 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -153.64 124.0 7.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.818 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.34 -122.84 15.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.536 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -113.07 36.08 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 165.53 29.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.3 p -117.07 116.0 50.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.151 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.13 159.38 21.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.7 p -100.92 176.76 5.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.793 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.416 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.16 -29.44 48.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.332 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.79 -58.05 9.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -71.27 -20.89 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.293 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 5.9 t80 -65.67 -30.11 70.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 111.144 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 4.0 m-85 -79.08 -44.44 22.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.1 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -79.26 -41.8 27.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.212 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -83.02 -55.72 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.259 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -96.99 37.07 1.34 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.914 0.387 . . . . 0.0 111.139 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -156.45 -167.38 17.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.455 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.4 m -59.79 150.05 29.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.786 0.327 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -153.65 175.5 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.882 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 47.2 t -88.0 132.1 34.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.992 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.4 27.45 4.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.037 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.445 ' CB ' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -55.34 1.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.964 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 23.7 p -111.16 -17.44 13.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.169 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 66.45 73.68 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.873 0.368 . . . . 0.0 110.882 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.453 ' CB ' ' CE1' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -127.97 -163.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.731 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -111.34 97.0 0.92 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.734 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.7 mt -82.03 129.31 64.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.426 0.155 . . . . 0.0 110.63 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 77.5 Cg_exo -48.5 173.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.281 1.987 . . . . 0.0 112.337 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.48 -47.54 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.558 2.172 . . . . 0.0 113.892 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.2 m -126.22 21.85 7.29 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.612 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -56.18 -171.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.539 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.02 108.3 22.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.782 0.325 . . . . 0.0 110.554 179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.403 ' O ' ' N ' ' A' ' 14' ' ' THR . 13.6 p -157.41 156.06 4.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.276 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.68 139.24 33.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.59 179.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.85 129.43 53.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.92 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.419 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.41 96.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.515 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.45 -88.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.857 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -88.8 -42.15 12.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.991 -1.004 . . . . 0.0 112.53 -177.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.4 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.2 m-85 -99.58 166.34 11.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.052 0.453 . . . . 0.0 112.12 -178.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.1 p -105.17 147.48 10.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.633 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.445 ' CE2' ' CB ' ' A' ' 124' ' ' ALA . 17.8 m-85 -132.62 142.59 49.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.881 0.372 . . . . 0.0 111.353 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 127' ' ' LEU . 66.4 m80 -70.4 145.08 51.33 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.02 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.97 -17.74 64.66 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -88.48 -46.48 9.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.544 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.83 -33.73 22.83 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.454 ' CE1' ' CD2' ' A' ' 171' ' ' LEU . 36.8 t80 -56.99 99.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.88 0.371 . . . . 0.0 110.972 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.01 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.108 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 150.01 26.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.943 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 23.7 m -70.44 -30.56 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.154 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 19.8 t -106.99 -51.5 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.125 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 42.5 m -66.05 -28.14 68.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 24.0 mttp 54.84 39.62 31.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.03 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -127.84 141.83 51.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.907 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -61.93 166.2 4.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -122.44 172.21 8.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 164.61 31.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.07 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -47.16 128.82 12.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.317 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.08 21.79 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -66.35 128.91 38.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.631 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -90.48 117.34 29.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.13 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.425 ' CD1' HG21 ' A' ' 10' ' ' VAL . 6.0 p90 -133.75 168.27 19.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.848 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.502 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 61.4 m-85 -114.71 171.03 7.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.768 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.71 123.2 30.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 10.2 mmt -83.13 168.74 16.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.971 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -59.75 -28.49 67.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.012 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -97.35 28.16 3.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.1 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.38 38.53 28.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.43 141.73 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.454 ' CD2' ' CE1' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.31 125.08 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.967 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 12.3 p -145.11 130.24 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.46 -173.44 4.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.023 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -61.08 2.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.08 -23.56 47.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.366 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -89.98 -23.38 21.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.063 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.502 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.1 t80 -54.54 -66.03 0.47 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.839 0.352 . . . . 0.0 111.045 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -55.56 -26.18 42.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.119 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 72.4 m -82.02 -27.66 32.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.12 -20.69 18.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.387 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.72 -178.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.5 m . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.76 0.314 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.5 p -104.73 107.89 19.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.49 -176.11 1.81 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.897 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.6 m -139.67 81.94 18.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.214 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.47 -41.47 3.35 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.57 2.18 . . . . 0.0 112.312 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -157.26 37.7 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 13.4 p -100.93 158.9 3.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.153 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.421 ' HE3' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.95 -177.95 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.595 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 6.2 p -155.1 131.84 2.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.276 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.446 HG22 ' CE1' ' A' ' 163' ' ' PHE . 52.9 t -55.41 146.16 4.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.09 -151.86 7.68 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.739 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -73.69 128.24 87.24 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.473 0.177 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -55.94 151.17 42.75 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.27 1.98 . . . . 0.0 112.342 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.04 149.75 7.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.36 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.449 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.0 OUTLIER -144.07 173.49 11.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.225 -179.471 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.17 -52.94 63.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.767 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.4 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 59.18 83.24 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.457 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -167.15 -43.55 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.519 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 63.45 27.3 15.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 0.0 110.774 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.508 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 61.23 -170.19 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.839 -179.983 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.05 150.26 22.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.522 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -83.91 -42.69 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.866 0.365 . . . . 0.0 110.965 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.87 -29.15 68.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.29 -74.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.949 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.425 ' HG2' ' CG ' ' A' ' 102' ' ' PHE . 30.5 tp10 -72.92 163.44 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.958 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -76.0 99.94 4.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 tp -77.38 163.25 26.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.906 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.7 pt -62.86 149.28 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.198 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 m -107.78 106.85 17.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.38 101.78 12.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.393 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.3 166.1 31.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.936 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -89.73 151.55 21.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -94.27 -178.57 4.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.855 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.8 m -133.29 35.65 3.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -97.49 -74.43 0.57 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 68.06 -69.64 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -105.7 83.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.885 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -131.15 79.1 1.87 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 69' ' ' HIS . . . 60.61 107.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.15 79.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.39 -126.24 0.79 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.462 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.422 ' N ' ' CD1' ' A' ' 42' ' ' ILE . 2.5 mp -84.12 -72.17 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.349 . . . . 0.0 110.885 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.7 171.02 3.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 60.5 80.09 0.22 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -100.74 80.53 2.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.53 130.54 10.27 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.553 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -90.34 107.66 3.47 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.515 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 m -66.31 98.56 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.868 0.366 . . . . 0.0 110.904 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 136.58 137.34 3.64 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.533 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.93 -28.68 14.08 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.508 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -158.47 -45.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.5 mtm -87.27 -178.14 6.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -100.88 -168.57 28.42 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.513 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -106.67 -170.06 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.909 0.385 . . . . 0.0 110.849 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 140.64 142.9 4.23 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.499 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.13 -160.8 27.27 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.512 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.51 83.0 10.37 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.701 0.286 . . . . 0.0 110.948 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.76 165.38 1.17 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.493 2.129 . . . . 0.0 112.195 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 58.64 30.66 20.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.412 HD11 ' CG ' ' A' ' 69' ' ' HIS . 8.3 tt -107.95 136.24 19.77 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.995 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.57 125.95 17.96 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.288 1.992 . . . . 0.0 111.98 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.6 157.72 15.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.177 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.402 ' HB2' HG12 ' A' ' 70' ' ' ILE . 4.9 t -58.26 142.49 47.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.455 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -62.9 114.75 3.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.27 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.72 28.53 46.55 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.997 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.43 -178.92 5.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.854 0.359 . . . . 0.0 110.944 -179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -109.19 -29.31 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.83 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -104.67 -165.67 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.847 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.418 ' CE1' ' HB1' ' A' ' 39' ' ' ALA . 3.7 p80 -106.6 173.42 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.986 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.402 HG12 ' HB2' ' A' ' 63' ' ' CYS . 8.3 mm -92.05 153.81 3.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.196 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.401 ' CD2' ' ND1' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -165.8 31.65 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.806 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.33 -178.96 3.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.23 -36.15 11.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.002 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -106.72 116.66 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.941 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.9 mm -134.41 154.02 36.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.284 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.6 mp -112.81 108.95 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.291 179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.71 123.3 34.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.1 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -158.32 161.06 37.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.055 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.409 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 57.59 35.83 26.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.017 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 62.63 35.81 14.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.82 168.94 5.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 41.6 p-80 -94.21 117.95 30.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.925 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.455 ' CD2' ' CB ' ' A' ' 64' ' ' ALA . 56.2 m95 -110.08 127.23 54.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.709 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.9 175.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.116 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.05 -39.26 30.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.651 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -91.06 -34.67 15.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 9.3 m -71.43 -28.4 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.7 tp -74.56 81.12 1.98 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.884 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -147.3 162.35 39.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.874 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.96 147.03 48.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -29.95 60.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.134 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.57 -63.01 1.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 19.4 m -59.31 -32.7 70.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.032 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 56.35 23.03 6.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.151 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -88.09 147.39 40.49 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.143 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.39 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.503 2.135 . . . . 0.0 112.286 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.4 mp -108.99 65.0 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.741 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.98 30.56 3.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.165 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -140.47 -49.64 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.21 167.37 22.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.819 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.0 t -157.0 127.96 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.984 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.481 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.5 OUTLIER -113.07 156.17 23.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.808 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.4 p -145.33 127.39 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.966 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -149.1 123.99 9.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -92.47 1.81 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.477 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -157.78 36.08 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.805 0.336 . . . . 0.0 110.838 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -154.82 152.16 29.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.876 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.15 115.99 27.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.064 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -118.84 158.13 26.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.2 p -99.93 171.7 7.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.691 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.04 -32.61 51.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.347 -179.724 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 3.7 t0 -51.53 -58.11 7.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.43 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -73.33 -20.68 60.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.328 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.508 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 8.5 t80 -62.32 -31.53 72.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.864 0.364 . . . . 0.0 110.815 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.3 m-85 -74.22 -35.26 63.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.755 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -85.09 -55.56 3.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.148 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -71.55 -48.26 49.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.348 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.42 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 5.4 m-85 -103.27 37.07 2.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.872 0.368 . . . . 0.0 111.087 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.74 173.13 35.07 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.06 155.03 14.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.717 0.294 . . . . 0.0 110.895 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.15 160.14 15.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.035 -179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -57.9 136.91 57.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.19 19.69 5.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.296 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.3 -48.29 1.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.827 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 1.8 m -111.02 -15.24 13.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.139 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 65.3 29.89 11.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.916 0.389 . . . . 0.0 110.627 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tp -82.62 136.08 34.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.765 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -55.69 99.96 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.731 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.1 mt -63.37 128.55 92.65 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.45 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 88.1 Cg_exo -44.22 169.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.547 2.165 . . . . 0.0 112.691 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.07 -47.03 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.622 2.214 . . . . 0.0 113.987 -178.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.4 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.11 21.41 8.09 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.45 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.0 OUTLIER -63.6 146.63 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -90.56 110.64 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 0.0 111.422 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.7 p -150.2 163.36 3.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.03 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . 0.413 ' HD2' ' CE2' ' A' ' 148' ' ' PHE . 0.0 OUTLIER -96.71 147.14 24.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.554 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.0 129.65 56.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.409 ' HB3' ' CD1' ' A' ' 143' ' ' TYR . . . -64.66 96.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.599 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 56.97 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.429 0.633 . . . . 0.0 111.686 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.0 m-20 -101.99 -48.75 4.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.776 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -82.06 160.6 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.725 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.4 p -106.23 153.46 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.58 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.409 ' CD1' ' HB3' ' A' ' 138' ' ' ALA . 33.0 m-85 -132.66 173.12 11.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.125 0.488 . . . . 0.0 111.389 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.82 163.15 27.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.904 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.8 -31.04 40.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.166 0.507 . . . . 0.0 109.741 178.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.25 -49.19 6.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.815 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 71.4 m -49.9 -38.04 34.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.318 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.44 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 0.5 OUTLIER -56.97 112.43 1.33 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 111.046 -179.692 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.06 171.73 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.95 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.77 149.98 37.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.93 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 9.9 m -75.55 -32.06 24.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.074 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.5 t -103.29 -49.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.13 -28.03 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 59.04 41.98 19.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.008 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -129.07 141.15 51.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.995 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -64.11 151.19 43.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.458 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.7 mm? -104.47 162.71 13.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.689 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.96 171.26 15.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.311 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 4.9 m -43.98 125.32 4.27 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.609 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.14 -22.49 38.23 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.769 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -68.55 131.3 45.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.772 0.32 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -87.88 128.45 35.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.008 -179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.449 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 8.3 p90 -145.03 140.56 28.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.127 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.501 ' CG ' ' CE1' ' A' ' 177' ' ' TYR . 54.1 m-85 -98.09 132.49 43.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.556 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.9 tp -87.96 111.0 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.839 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.5 mmt -74.77 148.76 40.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.901 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.72 -28.06 67.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.056 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -97.58 34.6 1.81 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 60.5 p 53.53 80.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.17 130.63 8.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.811 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.449 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.6 mp -92.5 128.77 38.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.958 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 6.6 p -144.99 118.84 2.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.907 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.2 p -66.56 -172.87 0.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.656 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -77.15 -39.26 49.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.355 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.11 -59.04 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.521 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -74.22 -9.33 58.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.501 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 8.6 t80 -57.05 -66.13 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -63.87 -28.59 69.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.009 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.0 m -77.77 -21.72 51.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.223 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.16 -29.85 13.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.774 0.321 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . 0.419 ' HE2' ' CD2' ' A' ' 177' ' ' TYR . 0.1 OUTLIER -170.35 -178.22 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 179.999 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.67 161.49 37.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 60.76 111.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.865 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.0 m -124.01 152.36 66.64 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.128 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.5 -46.25 1.41 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.519 2.146 . . . . 0.0 112.356 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 t0 60.41 176.21 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.833 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.452 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 9.1 p -110.24 126.92 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.489 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.426 ' HE1' ' CZ ' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -131.76 -163.06 1.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.427 ' HA ' ' HA ' ' A' ' 162' ' ' GLU . 9.8 p -147.58 132.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.442 HG21 ' CE1' ' A' ' 163' ' ' PHE . 21.6 t -55.58 146.19 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.224 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.33 -174.77 14.16 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.371 -0.919 . . . . 0.0 112.908 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 50.9 mt-10 -56.64 137.39 77.49 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.558 0.218 . . . . 0.0 110.935 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 14.7 Cg_exo -67.01 136.99 43.03 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.498 2.132 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.417 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.7 OUTLIER -166.07 142.97 5.22 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.113 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.547 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.6 OUTLIER -116.28 173.89 6.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 111.443 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -38.74 81.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.669 -179.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 71.67 55.72 7.22 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.336 -0.935 . . . . 0.0 111.975 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.04 23.24 30.28 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.804 -0.713 . . . . 0.0 113.042 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -51.07 95.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.868 0.366 . . . . 0.0 110.738 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 3.1 m-85 -57.79 -35.25 70.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.828 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.07 176.12 43.43 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.485 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -83.99 -30.79 25.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.844 0.354 . . . . 0.0 110.965 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.17 -31.83 73.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.66 -76.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.415 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 32.3 mm-40 -82.78 172.19 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.023 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -76.02 118.16 18.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 tp -95.71 165.15 12.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.939 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 6.4 pt -62.68 144.21 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.178 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.2 m -109.19 106.76 16.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -82.74 101.64 11.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.263 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.1 166.04 28.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.155 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.03 145.45 44.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -95.02 -167.68 1.67 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.869 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.2 t -82.35 58.6 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.924 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 pm0 45.26 -169.41 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.569 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.406 ' CZ ' HD12 ' A' ' 71' ' ' LEU . 4.4 t80 -91.9 -22.9 19.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.013 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -57.61 -20.52 33.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.43 -29.52 1.76 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.801 0.334 . . . . 0.0 111.479 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -125.93 -172.87 2.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.131 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -80.76 88.03 5.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.26 -43.66 0.14 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.7 tp -54.3 135.45 16.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.773 0.32 . . . . 0.0 111.402 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.25 87.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.847 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -165.76 -45.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.902 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -99.27 92.2 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 162.89 -131.16 2.41 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 139.31 -132.62 5.75 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.472 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.55 130.04 12.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.828 0.347 . . . . 0.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.25 61.75 1.31 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.507 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -88.87 -132.5 4.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.561 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -108.84 -33.66 6.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.842 0.353 . . . . 0.0 110.876 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 8.1 ptt? -168.83 -52.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.87 -161.1 28.62 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.442 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m 60.35 102.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.793 0.33 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -105.37 -106.34 3.11 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.516 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 61.1 168.92 0.54 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.466 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.12 143.12 25.57 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.686 0.279 . . . . 0.0 110.86 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.35 154.61 40.99 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.526 2.15 . . . . 0.0 112.352 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 57.27 28.9 15.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.923 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.459 ' CG2' ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -94.64 134.9 24.49 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.031 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -57.45 125.97 20.48 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.459 2.106 . . . . 0.0 111.981 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.01 146.8 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.148 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.9 t -57.1 155.29 8.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.421 ' HB1' ' CD2' ' A' ' 83' ' ' TRP . . . -80.08 114.71 19.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.565 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.38 -59.06 0.38 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.466 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.7 p -96.94 161.31 13.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -91.8 75.62 5.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -178.15 134.0 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.896 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.459 ' CD2' ' CG2' ' A' ' 60' ' ' ILE . 7.1 p80 -63.94 153.4 37.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.46 ' CD1' ' CE1' ' A' ' 84' ' ' HIS . 10.3 mm -79.24 151.26 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.406 HD12 ' CZ ' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -157.35 30.61 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -102.99 -178.98 3.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -35.52 8.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.678 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -106.18 107.2 18.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.683 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.4 mm -128.92 153.06 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 111.485 -179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.1 mp -108.6 110.33 21.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.147 179.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -90.68 126.55 36.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.247 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.69 165.73 31.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.963 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.07 34.63 25.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.108 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.87 40.18 9.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.088 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -177.53 169.03 2.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.943 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 34.6 p-80 -88.8 120.97 30.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.896 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.421 ' CD2' ' HB1' ' A' ' 64' ' ' ALA . 55.2 m95 -111.7 128.24 56.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.85 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.46 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.83 167.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.854 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 t -73.3 -39.5 65.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.748 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -91.08 -37.42 13.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.19 -31.53 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.958 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.9 tp -65.97 85.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.945 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -156.1 161.38 40.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.922 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 147.04 40.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.1 m -69.41 -28.82 66.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.048 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.77 -60.19 1.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.9 m -58.69 -39.12 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.034 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 57.48 22.43 8.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.4 m -85.37 154.39 59.66 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.188 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.71 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.486 2.124 . . . . 0.0 112.204 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.3 mp -111.12 57.88 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.728 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.2 43.19 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -157.43 -62.23 0.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.99 128.97 41.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 11.0 t -129.89 127.91 41.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.033 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.415 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 4.2 m-85 -111.48 171.94 7.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.731 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -149.5 137.24 20.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 110.973 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -169.44 123.97 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.842 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.99 17.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.613 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 60.86 38.31 17.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.831 0.348 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -156.18 156.29 33.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.862 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.9 p -78.0 120.72 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.118 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -124.79 151.56 45.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.944 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 24.4 p -103.32 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.436 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.06 -41.01 36.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.291 -179.653 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -43.53 -58.04 2.82 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.59 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -75.58 -20.49 58.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 20' ' ' PHE . 56.0 t80 -64.32 -35.31 80.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.013 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 33.4 m-85 -67.63 -44.69 77.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.036 0.446 . . . . 0.0 110.87 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -80.49 -32.55 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.314 -179.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -80.82 -56.59 4.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.341 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.432 ' CG ' ' CE1' ' A' ' 114' ' ' PHE . 5.4 m-85 -95.48 -43.06 8.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.155 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -66.58 -150.64 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.3 m -103.18 154.05 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.68 0.276 . . . . 0.0 110.71 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 179.36 6.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 111.268 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . 0.41 ' N ' ' CD1' ' A' ' 129' ' ' ILE . 49.8 t -78.85 141.73 37.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.079 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.15 20.3 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.438 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -49.36 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.893 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 19.9 p -111.22 -17.66 13.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 67.35 47.09 1.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.956 0.408 . . . . 0.0 111.097 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.11 -162.08 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.58 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -117.33 79.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.903 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.41 ' CD1' ' N ' ' A' ' 122' ' ' CYS . 2.1 mp -59.53 139.09 89.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.497 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 73.9 Cg_exo -46.84 172.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.248 1.965 . . . . 0.0 111.989 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.426 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.3 Cg_endo -77.13 -55.02 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.305 2.003 . . . . 0.0 113.798 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.84 22.17 9.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.547 ' HG3' ' CD1' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.55 -166.85 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.521 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -122.77 111.68 31.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.967 0.413 . . . . 0.0 111.412 -179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 14' ' ' THR . 14.1 p -148.74 162.72 5.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.493 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.02 137.97 34.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.897 0.38 . . . . 0.0 110.891 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.65 173.09 6.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.748 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -142.21 134.4 27.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.931 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.505 ' HG2' ' C ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER 39.65 -84.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.609 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 138' ' ' ALA . 10.7 t0 -144.33 41.08 1.35 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.815 0.34 . . . . 0.0 111.152 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.432 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . 10.8 m-85 -148.11 165.05 32.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 14.6 p -115.51 121.11 66.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.432 ' CE1' ' HB2' ' A' ' 141' ' ' PHE . 51.0 m-85 -113.61 140.1 48.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.283 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 3.3 m80 -58.87 150.4 24.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.802 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.74 -21.92 64.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.19 -49.14 6.54 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.598 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 63.9 m -57.04 -40.77 77.42 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.916 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.456 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 0.2 OUTLIER -56.85 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.119 -179.698 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.15 172.8 4.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.795 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.7 t -82.13 150.25 27.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.208 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 29.1 m -73.62 -31.89 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.304 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 20.5 t -99.46 -57.57 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.467 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.2 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.104 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? 60.0 44.5 13.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . 0.4 ' HB2' ' NH1' ' A' ' 155' ' ' ARG . 0.0 OUTLIER -128.95 139.63 52.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.079 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 148' ' ' PHE . 10.9 mp0 -66.58 166.31 13.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.428 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.2 mm? -122.22 166.42 14.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.396 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 169.16 19.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.029 0.442 . . . . 0.0 111.472 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 7.4 m -43.79 129.29 5.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.654 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 92.71 -21.36 39.37 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.882 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -73.91 130.96 40.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.835 0.35 . . . . 0.0 110.791 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 14.4 mt-10 -87.99 127.07 35.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.019 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.447 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 25.9 p90 -134.62 179.07 6.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.419 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.524 ' CG ' ' CE1' ' A' ' 177' ' ' TYR . 16.1 m-85 -133.08 115.04 14.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.333 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . 0.428 HD13 ' CG ' ' A' ' 139' ' ' GLN . 5.9 tt -87.97 110.78 20.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 110.595 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 18.4 mmt -75.96 164.33 26.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.24 -28.13 62.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.171 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -97.38 28.92 3.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.54 33.96 23.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.987 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -98.39 98.55 9.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.456 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -66.97 133.11 49.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.788 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 2.7 p -145.18 140.26 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.0 m -71.46 -178.43 2.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.965 0.412 . . . . 0.0 111.313 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.11 -31.15 22.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.885 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.57 25.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.451 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -83.0 4.15 27.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.648 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.524 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 27.9 t80 -61.77 -66.14 0.58 Allowed 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.08 0.467 . . . . 0.0 110.966 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.03 -28.78 0.74 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.826 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -31.53 57.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.367 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.1 -31.74 12.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.514 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 64.42 174.28 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.868 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.839 0.352 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 t -70.94 106.25 3.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.936 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -151.23 31.63 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.5 m -110.12 82.03 2.4 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.061 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.53 -37.59 7.15 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.547 2.165 . . . . 0.0 112.306 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -152.54 80.12 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.907 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 13.2 p -115.36 159.13 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.434 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -145.08 179.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.605 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.7 p -155.03 135.38 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.358 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.425 HG22 ' CE1' ' A' ' 163' ' ' PHE . 43.9 t -60.42 146.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.45 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -130.14 -160.72 10.18 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.777 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 4.5 mm-40 -64.0 132.02 95.14 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.579 0.228 . . . . 0.0 110.832 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 21.9 Cg_exo -63.16 143.64 90.48 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.311 2.008 . . . . 0.0 112.337 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.13 155.01 11.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.372 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.515 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.1 OUTLIER -144.09 173.88 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.138 0.494 . . . . 0.0 111.697 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -68.38 0.24 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.144 -179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.49 63.32 1.57 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.268 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -109.45 -70.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.543 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 72.42 84.01 0.13 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.908 0.385 . . . . 0.0 110.793 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.483 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.4 OUTLIER -57.28 -167.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.926 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -177.51 179.69 48.08 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.581 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -81.32 -30.03 34.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 110.955 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -58.26 -26.26 62.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -56.99 -68.56 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.076 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.419 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 6.5 mm-40 -103.42 176.02 5.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.939 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 121.8 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.65 162.08 13.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.84 158.28 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 m -123.8 106.95 10.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.827 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.04 101.86 6.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.68 162.22 37.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.409 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 6.3 mp0 -81.61 156.99 24.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.892 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -107.5 171.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.2 t -97.89 37.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -127.02 163.09 24.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -169.76 -42.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -142.08 80.26 1.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.965 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -143.55 93.42 2.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.139 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.6 107.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.069 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.2 79.32 0.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -107.96 -115.57 3.93 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.523 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.8 mm -82.3 80.56 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.825 0.345 . . . . 0.0 110.963 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 60.33 110.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -176.58 87.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -102.8 97.42 7.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.902 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.06 111.62 3.91 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 59.99 95.55 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.8 p -104.57 159.92 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.874 0.369 . . . . 0.0 110.905 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.75 -58.76 0.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.508 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.57 169.76 43.93 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.477 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -37.73 88.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.935 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.6 ptp -169.45 81.45 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.45 -44.95 49.58 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.475 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.3 t -146.29 93.02 2.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.795 0.331 . . . . 0.0 110.857 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 144.3 -145.6 15.3 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.488 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.55 117.44 0.53 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.579 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.93 83.01 65.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 110.929 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.99 168.73 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.546 2.164 . . . . 0.0 112.232 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 57.88 30.25 18.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.417 HD12 ' CG ' ' A' ' 69' ' ' HIS . 8.8 tt -105.01 136.65 19.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.975 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.71 125.88 20.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.351 2.034 . . . . 0.0 111.799 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.87 134.51 38.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.262 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.439 ' HB2' HG12 ' A' ' 70' ' ' ILE . 3.2 t -59.27 141.82 53.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.774 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.417 ' HB2' ' CE2' ' A' ' 83' ' ' TRP . . . -63.38 114.84 4.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.132 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.91 26.37 45.57 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.025 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -128.67 -178.88 4.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.798 0.333 . . . . 0.0 110.832 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -134.99 35.61 3.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.951 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' CG ' ' CE1' ' A' ' 69' ' ' HIS . 16.2 tt0 -151.7 -88.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.446 ' CE1' ' CG ' ' A' ' 68' ' ' GLN . 1.5 p80 175.75 -179.18 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.758 0.313 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.439 HG12 ' HB2' ' A' ' 63' ' ' CYS . 3.2 mm -103.33 150.88 6.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.022 0.439 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.83 37.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.85 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -109.38 170.35 8.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.912 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -70.05 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.409 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -90.3 140.23 29.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.7 mm -141.56 151.24 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.16 106.96 17.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.496 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -90.83 115.48 27.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.978 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -152.71 167.03 30.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.115 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 mt 57.5 35.34 25.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.068 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 62.59 35.52 14.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.032 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -172.47 176.11 3.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.027 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.423 ' CD2' HG13 ' A' ' 70' ' ' ILE . 48.7 p-80 -95.43 117.95 31.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.417 ' CE2' ' HB2' ' A' ' 64' ' ' ALA . 61.5 m95 -110.72 125.79 53.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.731 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.93 175.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 t -80.01 -40.55 27.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.484 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -91.12 -19.71 22.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.27 17.65 9.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.306 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.93 73.59 1.47 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -127.26 150.49 49.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -60.48 126.42 27.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.799 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.4 m -58.48 -20.8 48.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.472 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -102.87 -63.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.765 0.317 . . . . 0.0 111.347 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 21.8 m -68.98 -30.18 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.25 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 15.0 t-160 57.87 22.35 8.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.028 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.9 m -87.23 152.21 52.45 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.177 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.93 118.97 5.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.24 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.3 mp -113.17 56.41 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.663 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.42 28.62 3.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.202 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -135.09 -46.54 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.781 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.9 mtm180 -148.75 138.02 21.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.804 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.5 t -112.96 156.02 23.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.436 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -158.14 120.72 3.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.4 t -112.93 152.96 28.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.75 123.95 8.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.56 -104.99 1.32 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.443 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -67.72 0.89 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.788 0.327 . . . . 0.0 110.825 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.7 m -70.08 -176.97 1.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.5 p -110.57 116.0 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.096 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -113.86 120.9 42.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -63.98 173.99 1.66 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.847 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.06 -30.0 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 22.6 t0 -53.33 -58.01 8.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.312 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -71.93 -20.72 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.079 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.483 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 8.6 t80 -62.04 -27.22 68.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 2.3 m-85 -79.15 -44.56 21.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt -85.41 -62.39 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.466 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -58.16 -52.09 67.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.762 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -88.46 -43.03 11.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.347 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.41 -159.9 17.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.416 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -103.09 142.92 33.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.786 0.327 . . . . 0.0 110.827 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 173.87 11.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.074 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.2 138.18 58.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.55 29.59 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.122 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.18 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.923 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 10.3 p -109.9 8.03 24.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.325 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 57.96 29.86 18.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.815 0.34 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.3 tp -87.55 143.82 27.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.787 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.65 103.69 1.24 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.698 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 53.8 mt -60.76 134.34 92.18 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.5 0.19 . . . . 0.0 110.489 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.489 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 80.4 Cg_exo -45.99 172.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.507 2.138 . . . . 0.0 112.54 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.72 -55.37 0.09 OUTLIER 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.856 2.37 . . . . 0.0 113.393 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -126.14 22.05 7.31 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.515 ' HG3' ' CD1' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -53.57 -178.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.492 179.836 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -121.52 111.96 33.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.908 0.385 . . . . 0.0 111.123 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 7.1 p -157.09 164.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.952 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.59 138.18 34.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.493 179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.72 130.08 52.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.785 -179.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.435 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.86 96.0 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 37.64 -88.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.1 m-20 -79.2 -34.27 43.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.789 -176.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.444 ' N ' ' CD1' ' A' ' 141' ' ' PHE . 1.3 m-85 -115.71 178.25 4.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 112.23 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.407 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 9.9 p -113.62 152.19 15.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.598 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -132.06 174.99 9.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.167 0.508 . . . . 0.0 111.561 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.48 166.63 20.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.014 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.19 -33.42 33.01 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.32 -49.31 6.42 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.891 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 65.7 m -51.53 -35.06 38.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.201 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' A' ' 156' ' ' GLN . 0.1 OUTLIER -56.92 117.97 4.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.221 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.34 -176.95 1.69 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.885 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.3 t -100.36 150.08 22.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.957 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 8.4 m -69.33 -27.47 34.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.4 t -104.99 -55.69 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.351 -179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.3 m -65.96 -27.92 68.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.979 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 17.9 tttt 58.04 31.94 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -123.97 144.18 49.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.015 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 148' ' ' PHE . 7.0 mt-30 -61.92 162.41 9.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.322 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.487 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.4 mm? -113.99 165.22 12.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.47 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.99 168.75 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.489 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 5.3 m -43.46 128.42 4.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.67 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.63 -25.35 23.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.681 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 129.69 40.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.784 0.326 . . . . 0.0 110.758 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.89 124.17 33.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.005 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.451 ' CD2' ' CD2' ' A' ' 171' ' ' LEU . 7.1 p90 -140.18 147.72 40.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.012 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.456 ' CG ' ' CD1' ' A' ' 177' ' ' TYR . 36.8 m-85 -102.16 159.72 15.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.86 110.94 21.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.757 179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 13.0 mmt -74.63 166.25 23.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.029 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -60.62 -26.96 67.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -96.95 27.93 3.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.073 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 57.46 40.02 27.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.068 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -104.03 141.54 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -93.3 130.86 38.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.06 123.68 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.073 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 26.4 m -56.51 -170.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.95 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -74.4 -57.68 3.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.55 82.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.073 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -65.46 -25.7 67.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.957 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.456 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 9.5 t80 -54.67 -66.13 0.46 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.01 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.78 -32.83 73.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 57.7 m -67.4 -31.56 71.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -80.55 -51.96 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.104 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.35 -67.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . 0.451 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 1.6 mt-30 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.935 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.805 0.336 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 m -80.56 164.98 22.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.895 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.59 31.48 0.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.4 m -131.21 81.26 66.42 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.161 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.56 -168.02 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.61 2.207 . . . . 0.0 112.269 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -59.73 102.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.426 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 11.9 p -119.76 158.63 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -154.49 -178.17 6.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.8 p -155.05 136.29 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.004 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.422 HG21 ' CE1' ' A' ' 163' ' ' PHE . 30.1 t -52.88 146.3 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.903 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -140.86 -144.14 4.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.817 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -76.59 120.14 80.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.552 0.215 . . . . 0.0 110.808 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -62.82 140.08 78.06 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.344 2.029 . . . . 0.0 112.127 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.36 164.55 34.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.462 ' CD1' ' HG3' ' A' ' 133' ' ' GLN . 0.5 OUTLIER -138.0 173.44 11.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -29.18 68.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.809 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 131' ' ' PRO . . . 55.14 87.31 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.619 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.33 124.3 1.18 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.569 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -107.08 22.78 15.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.709 0.29 . . . . 0.0 110.865 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 63.3 -179.9 0.15 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.38 133.04 6.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.532 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -58.31 -30.53 66.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.836 0.35 . . . . 0.0 110.994 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -59.71 -28.64 67.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -58.52 -68.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 1.6 mm-40 -95.4 176.08 6.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.98 144.18 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.84 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tp -112.01 165.14 12.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.931 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.5 mm -62.79 157.54 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -124.75 106.95 10.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.924 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 101.88 12.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.546 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -139.71 149.62 43.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.945 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.21 145.31 37.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -108.91 -26.51 10.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.031 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 15.0 t 45.31 36.0 2.09 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -113.78 34.69 4.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.825 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -59.58 -69.21 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -69.85 78.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -115.74 -39.38 3.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.15 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -175.13 107.59 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.127 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m120 62.76 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.025 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.1 -114.98 4.2 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.508 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.416 ' N ' ' CD1' ' A' ' 42' ' ' ILE . 2.5 mp -84.31 -46.58 17.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.38 162.79 26.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.908 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -142.16 156.8 45.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -73.17 148.94 43.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -138.03 154.11 22.62 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.549 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -177.99 -61.13 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.53 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -165.63 -74.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.774 0.321 . . . . 0.0 110.826 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.99 -67.5 0.71 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.511 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 173.06 -153.82 19.17 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.576 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -105.17 166.48 10.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.869 0.366 . . . . 0.0 110.883 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 97.7 mmm -90.34 120.94 31.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.862 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.76 28.55 73.02 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.452 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 60.38 168.98 0.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.807 0.337 . . . . 0.0 110.942 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -149.94 -175.59 22.27 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.456 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 135.99 -160.75 24.71 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.446 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.0 89.56 2.5 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 110.848 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.35 164.59 30.03 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.459 2.106 . . . . 0.0 112.187 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.88 30.63 20.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.749 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.415 HG12 ' CG ' ' A' ' 69' ' ' HIS . 3.3 tp -104.76 135.3 19.32 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.067 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -58.0 125.93 20.08 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.412 2.075 . . . . 0.0 112.035 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.17 138.67 31.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -57.43 164.19 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.869 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.424 ' CB ' ' CE3' ' A' ' 83' ' ' TRP . . . -84.29 114.61 21.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.377 179.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.16 -82.1 0.35 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.482 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.0 p -91.34 154.2 19.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 110.94 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -75.8 88.86 2.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -178.53 135.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.415 ' CG ' HG12 ' A' ' 60' ' ' ILE . 11.1 p80 -72.23 145.28 48.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.01 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.452 ' CD1' ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -72.27 153.35 7.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.16 36.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -112.07 138.14 49.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.815 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 74' ' ' PHE . 0.0 OUTLIER -55.15 -34.06 63.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.192 -179.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.41 ' N ' ' HG2' ' A' ' 73' ' ' ARG . 2.0 m-85 -106.55 107.71 18.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.052 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.9 mm -123.5 153.44 29.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.078 0.466 . . . . 0.0 111.258 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -115.15 106.94 14.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.167 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 46.0 tttt -90.66 123.11 34.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.026 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.19 167.04 31.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.066 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.7 mt 57.29 34.12 24.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.125 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.84 34.3 14.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.79 171.98 5.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.058 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -89.72 117.94 28.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.852 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.424 ' CE3' ' CB ' ' A' ' 64' ' ' ALA . 47.4 m95 -111.44 126.08 54.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.848 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 1.0 OUTLIER -52.53 143.66 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.931 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.3 p -57.59 -37.58 73.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -91.08 -12.77 34.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.261 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 61.5 m -104.95 22.44 15.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.687 0.28 . . . . 0.0 111.152 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.2 tp -118.88 30.63 7.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.859 0.362 . . . . 0.0 110.864 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.6 153.27 20.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.871 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 5.4 t -59.33 147.02 37.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.74 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.77 -28.43 66.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.294 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -105.03 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 0.0 111.253 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.2 m -58.82 -29.44 66.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.166 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 57.77 21.8 7.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.134 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.8 m -90.46 156.61 45.44 Favored Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.166 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 118.94 5.77 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.443 2.095 . . . . 0.0 112.245 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.3 mp -101.29 72.27 1.42 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.898 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.5 30.6 3.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.084 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -146.6 -47.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.3 158.35 44.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.776 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 26.7 p -141.85 175.95 9.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.034 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' CE2' ' A' ' 114' ' ' PHE . 1.1 t80 -162.72 152.14 15.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.773 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -134.22 135.04 42.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.413 ' HG3' ' CZ ' ' A' ' 118' ' ' PHE . 28.5 mmt-85 -147.95 124.0 10.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.31 1.6 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -166.29 -44.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 110.872 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.05 179.84 1.41 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.929 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 12.4 p -108.25 123.0 63.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.008 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.42 169.53 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.866 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 21.0 p -121.85 168.21 12.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.634 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 8.6 mttp -78.14 -26.75 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -54.58 -49.77 69.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.265 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -83.94 -20.53 32.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 20' ' ' PHE . 9.0 t80 -61.41 -30.5 70.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.977 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.434 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.1 m-85 -69.19 -45.94 68.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.758 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -85.44 -60.77 1.93 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.594 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.27 -52.83 63.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.168 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.413 ' CZ ' ' HG3' ' A' ' 104' ' ' ARG . 5.0 m-85 -84.29 -43.06 15.19 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.402 ' HA3' ' O ' ' A' ' 115' ' ' PHE . . . -64.3 -136.96 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.514 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.5 m -103.06 153.97 19.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.732 0.301 . . . . 0.0 110.789 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.76 162.27 41.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.266 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.3 t -57.47 139.33 53.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.978 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.73 29.46 2.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.17 -58.15 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 15.1 p -107.67 10.37 29.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.358 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.22 36.24 27.12 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.783 0.325 . . . . 0.0 110.973 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 15.3 tp -99.73 137.4 38.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.939 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.99 131.74 36.52 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.658 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.427 ' CD1' ' CG1' ' A' ' 142' ' ' VAL . 12.0 mt -95.09 128.22 39.74 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.395 0.141 . . . . 0.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.596 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 82.4 Cg_exo -42.73 168.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.615 2.21 . . . . 0.0 112.614 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.426 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 23.2 Cg_exo -65.46 -55.36 0.46 Allowed 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.75 2.3 . . . . 0.0 113.843 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.52 21.49 7.8 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.596 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.1 pp0? -61.07 136.94 58.23 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.376 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 1.5 t -71.91 108.73 3.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.009 0.433 . . . . 0.0 111.054 -179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 11.0 p -144.83 159.33 14.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.906 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.79 136.22 37.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.03 164.31 12.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.033 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 143' ' ' TYR . . . -106.41 96.71 6.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.667 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 57.92 -86.24 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.361 0.6 . . . . 0.0 111.746 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.97 -49.18 4.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.789 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -84.25 161.26 20.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.597 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.427 ' CG1' ' CD1' ' A' ' 129' ' ' ILE . 7.2 p -103.89 152.21 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.553 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.412 ' CD1' ' HB3' ' A' ' 138' ' ' ALA . 19.5 m-85 -128.54 175.13 8.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.129 0.49 . . . . 0.0 111.654 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 163.4 21.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.041 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.23 -31.71 33.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.734 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -49.28 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.789 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 78.4 m -52.48 -32.35 39.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.991 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.418 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -57.05 119.82 6.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.034 -179.822 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.27 -177.04 1.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.975 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.9 t -101.47 150.09 23.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.03 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . 0.401 ' CG1' ' CG ' ' A' ' 170' ' ' ARG . 24.6 m -68.81 -26.87 33.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.335 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 27.3 t -107.03 -56.41 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.25 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.1 m -65.88 -28.13 68.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.101 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.11 34.9 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -126.42 142.34 51.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.969 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -58.38 152.79 16.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.262 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.482 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.3 mm? -109.5 107.96 18.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . 0.413 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -91.3 168.06 11.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.475 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.9 m -40.73 132.33 2.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.83 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.07 -26.99 16.32 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.618 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -67.8 128.92 38.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.331 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -87.99 114.5 24.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.825 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.452 ' CE2' ' CE ' ' A' ' 8' ' ' MET . 11.5 p90 -128.16 143.62 51.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.015 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 11.1 m-85 -100.13 162.43 12.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.748 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -115.04 110.85 20.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.742 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.8 mmt -75.4 164.47 26.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.015 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -59.16 -26.26 64.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.129 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.71 27.09 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.099 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.0 46.76 18.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.922 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 0.1 OUTLIER -110.88 146.54 36.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -98.31 128.89 44.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 7.6 p -145.07 130.18 13.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 55.5 m -53.0 -179.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.108 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.411 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 0.5 OUTLIER -67.95 -61.03 2.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.32 72.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -63.58 -26.96 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.002 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -55.07 -66.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.007 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -53.99 -26.74 27.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.23 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.1 m -78.48 -30.16 47.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.976 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -93.74 -27.25 16.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.233 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm 63.28 173.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.885 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.79 160.29 15.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.878 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -176.3 -175.97 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.415 HG12 ' CZ ' ' A' ' 164' ' ' TYR . 22.0 t -106.21 88.04 2.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 164.25 35.36 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.565 2.177 . . . . 0.0 112.285 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 60.83 87.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.43 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 14.0 p -126.04 158.81 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.1 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.416 ' HE2' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.75 -175.09 3.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.636 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.2 p -154.39 150.8 11.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.156 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.433 HG21 ' CD1' ' A' ' 163' ' ' PHE . 38.4 t -67.39 146.25 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.706 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.66 -162.03 10.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.388 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -71.5 145.37 90.14 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.568 0.223 . . . . 0.0 110.63 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 4.5 Cg_endo -83.02 130.0 5.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.58 163.73 37.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.395 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 133' ' ' GLN . 0.7 OUTLIER -144.08 173.78 11.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.173 0.511 . . . . 0.0 111.621 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.7 -38.27 87.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.428 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.445 ' HA2' ' CA ' ' A' ' 132' ' ' THR . . . 64.24 81.54 0.11 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.65 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.72 -140.8 5.56 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.248 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 179.68 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.405 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 63.11 144.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.933 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 -160.45 8.9 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.534 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -83.98 -25.32 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.694 0.283 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -54.09 -26.64 28.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.245 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.43 -75.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.059 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 18.6 tp10 -101.79 163.5 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.867 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ptp85 -75.9 100.01 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.33 165.21 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.87 138.58 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.14 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 48.5 m -105.86 106.93 17.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.824 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -78.34 101.69 7.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.394 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.73 164.92 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.007 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.451 ' CG ' ' CE1' ' A' ' 74' ' ' PHE . 19.6 mt-10 -90.26 157.02 17.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -109.73 -29.41 8.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 22.5 m 62.18 31.41 17.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -115.86 71.71 0.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -105.39 31.29 5.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -158.53 79.78 0.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.927 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.53 -47.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.02 125.76 12.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.012 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m120 64.25 -78.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.2 -89.14 0.65 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.464 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.9 mm -82.08 158.47 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.794 0.33 . . . . 0.0 110.96 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -97.3 39.7 1.18 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -143.9 80.16 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.881 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -91.22 -31.39 16.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.855 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -72.79 131.96 16.75 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.484 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.74 -40.76 2.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.536 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 p -104.92 -178.56 3.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.925 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -83.06 -83.85 0.88 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.51 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.08 29.89 6.97 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.2 t60 60.47 169.11 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -133.1 163.02 30.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.63 55.9 2.09 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.51 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.63 -171.28 0.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.768 0.318 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 158.11 -30.99 0.49 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.454 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.32 148.21 11.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.534 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.67 86.25 12.55 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.733 0.302 . . . . 0.0 110.875 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -51.71 165.82 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.463 2.109 . . . . 0.0 112.247 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.65 30.8 20.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.81 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.421 HG23 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -108.91 134.92 20.2 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -63.06 125.92 16.87 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.347 2.031 . . . . 0.0 112.163 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.75 147.36 26.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.2 t -59.01 154.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.905 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -82.86 114.81 21.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.575 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.7 -53.37 0.62 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.43 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 19.3 p -103.61 -178.99 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.767 0.318 . . . . 0.0 110.876 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.03 76.56 1.01 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.76 131.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.421 ' CD2' HG23 ' A' ' 60' ' ' ILE . 9.7 p80 -63.97 148.14 50.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.433 HD12 ' CE1' ' A' ' 84' ' ' HIS . 5.7 mm -77.08 153.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.01 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.406 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -172.64 35.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.832 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -104.88 179.11 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.86 -68.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.451 ' CE1' ' CG ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -80.99 115.96 20.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.9 mm -123.2 154.93 29.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.301 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.59 107.59 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.264 179.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -90.77 122.44 33.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.063 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -159.88 158.29 30.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.173 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 58.19 37.46 26.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.157 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 61.67 35.71 16.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.074 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -174.39 169.98 3.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.863 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.419 ' CD2' HG13 ' A' ' 70' ' ' ILE . 20.6 p-80 -89.33 125.31 35.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.961 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.422 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 58.6 m95 -113.65 125.36 54.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.433 ' CE1' HD12 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.71 171.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.063 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.05 -39.83 28.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -90.97 -28.26 18.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.988 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 79.1 m -71.96 -28.96 63.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.049 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 11.2 tp -79.59 82.83 5.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -137.63 150.59 47.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.4 t -64.25 130.06 42.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.789 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -23.49 52.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.491 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.13 -63.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.787 0.327 . . . . 0.0 111.226 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.0 m -66.54 -33.07 74.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.172 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.08 22.63 7.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.051 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.9 m -87.85 152.15 50.81 Favored Pre-proline 0 N--CA 1.453 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.227 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -57.24 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.504 2.136 . . . . 0.0 112.169 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.2 mp -108.86 64.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.746 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.97 29.42 3.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -135.11 -46.51 0.71 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.05 173.48 11.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.5 t -156.94 156.04 32.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.017 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . 0.472 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -155.96 136.09 12.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.746 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 2.0 p -151.03 174.12 13.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.009 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -177.2 123.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.29 -95.55 1.86 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.535 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -142.19 38.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.906 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.417 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 0.7 OUTLIER -152.65 177.96 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.3 p -149.13 115.99 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.187 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.417 ' CZ ' ' HB2' ' A' ' 107' ' ' SER . 0.4 OUTLIER -122.15 159.89 26.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.2 p -71.53 160.22 33.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.656 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.411 ' HG2' ' CZ ' ' A' ' 115' ' ' PHE . 6.1 ttmt -56.94 -45.12 82.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.074 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.426 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 30.1 t70 -58.91 -29.5 67.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.107 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -84.1 -26.07 29.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.318 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 36.7 t80 -66.8 -39.06 87.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 112' ' ' ASP . 7.5 m-85 -65.38 -39.51 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.1 tttp -84.13 -30.12 26.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.119 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.9 mmm-85 -82.09 -53.79 5.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.192 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.25 -42.99 11.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.5 167.7 53.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.419 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 33.0 m -58.5 150.27 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.756 0.312 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -145.49 163.31 35.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.051 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 48.6 t -72.8 130.7 41.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.88 28.01 4.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.106 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.1 -54.62 1.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 26.8 p -111.08 -22.61 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 69.67 69.81 0.24 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.11 -166.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.792 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -103.5 86.95 0.55 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.557 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.406 ' CG2' HD12 ' A' ' 15' ' ' LEU . 16.3 mt -65.94 126.28 91.53 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.455 0.169 . . . . 0.0 110.833 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.567 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.4 Cg_exo -51.49 -178.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.233 1.955 . . . . 0.0 111.959 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 64.9 Cg_endo -77.24 -53.25 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.298 1.998 . . . . 0.0 113.901 -179.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.445 ' CA ' ' HA2' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.94 21.83 9.77 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.567 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 1.0 OUTLIER -55.49 145.33 23.14 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.365 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -87.79 108.9 18.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.963 0.411 . . . . 0.0 110.862 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 11.4 p -150.5 159.82 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.078 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.71 137.55 35.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.83 130.67 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.975 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.416 ' HB1' ' CE1' ' A' ' 143' ' ' TYR . . . -70.71 96.65 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.748 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 55.31 -86.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.386 0.612 . . . . 0.0 111.797 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.414 ' OD2' ' CZ ' ' A' ' 141' ' ' PHE . 5.5 p-10 -99.6 -47.56 5.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.723 -178.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.414 ' CZ ' ' OD2' ' A' ' 140' ' ' ASP . 3.5 m-85 -79.26 163.24 25.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.95 133.05 61.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' TYR . . . . . 0.416 ' CE1' ' HB1' ' A' ' 138' ' ' ALA . 5.0 m-85 -111.06 171.45 7.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.05 0.452 . . . . 0.0 111.344 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 41.1 m80 -99.52 140.01 34.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.844 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.73 -20.07 45.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.01 -36.49 14.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.266 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 14.27 32.39 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.454 ' CZ ' ' CD2' ' A' ' 171' ' ' LEU . 42.5 t80 -104.05 102.31 12.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.71 0.29 . . . . 0.0 110.657 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -156.86 -176.92 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.26 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -92.23 150.04 21.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 16.8 m -65.59 -26.7 39.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.315 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 21.3 t -104.43 -56.28 5.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.345 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 20.3 m -65.91 -28.12 68.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.074 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 30.0 7.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.13 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -119.14 153.05 35.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -68.24 154.08 42.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . 0.455 ' N ' ' CD2' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -115.9 137.46 52.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -109.34 161.28 15.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.039 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.7 t -46.23 130.28 10.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.372 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 109.34 -34.36 5.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.591 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -65.17 130.29 42.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.722 0.296 . . . . 0.0 110.784 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -87.96 119.65 28.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.961 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' PHE . . . . . 0.433 ' CD1' HG21 ' A' ' 10' ' ' VAL . 5.7 p90 -134.01 147.57 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' TYR . . . . . 0.43 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 30.9 m-85 -100.59 147.3 26.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.673 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.41 114.19 28.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.5 mmt -69.39 174.49 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -66.81 -29.08 68.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.028 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -97.74 29.8 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.028 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.86 33.95 23.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.949 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -88.57 132.73 34.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' LEU . . . . . 0.454 ' CD2' ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -84.94 121.01 27.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 14.6 p -145.02 121.56 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.124 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 56.1 m -54.88 -174.37 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.856 0.36 . . . . 0.0 111.084 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -69.44 -60.94 2.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.15 -38.96 84.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.021 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -59.25 -24.77 63.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.412 ' CD2' HG13 ' A' ' 4' ' ' VAL . 5.4 t80 -54.77 -63.72 1.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -49.18 -27.9 3.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.304 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 -25.33 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.95 -20.55 20.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.518 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.48 -177.58 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.836 0.351 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 179.989 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 8' ' ' MET . 13.5 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.852 0.358 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.49 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.74 -179.96 6.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.682 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.5 p -155.06 137.0 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.115 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.413 HG21 ' CB ' ' A' ' 157' ' ' LEU . 48.1 t -57.88 146.14 8.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.565 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.681 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -133.62 -151.11 6.44 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.782 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -71.8 122.57 87.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.446 0.165 . . . . 0.0 110.954 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.0 Cg_exo -64.44 142.92 80.62 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.328 2.019 . . . . 0.0 112.149 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.04 158.43 14.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.851 HD11 HG22 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -129.2 173.31 10.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.155 0.502 . . . . 0.0 111.267 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -37.84 81.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.932 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.754 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.01 79.62 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.552 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -145.55 -55.35 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 64.19 29.48 13.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.729 0.299 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 58.93 -168.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.973 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -148.99 125.3 2.0 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -59.9 -31.53 69.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.51 -30.23 70.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.46 -74.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 5.7 tp10 -78.2 151.35 33.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.977 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -76.08 101.96 5.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.875 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 100' ' ' ARG . 1.7 tp -73.92 165.13 25.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.784 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 6.0 pt -62.86 137.61 24.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -104.34 106.89 17.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD2' HD12 ' A' ' 28' ' ' ILE . 0.0 OUTLIER -83.1 101.77 11.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.469 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.576 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.4 157.31 44.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.001 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.08 116.88 18.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.6 163.71 23.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.5 t -107.4 31.57 5.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -104.1 37.63 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -98.69 31.49 2.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.911 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -167.31 33.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.844 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.145 179.932 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.684 0.278 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.74 167.15 23.8 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.468 2.112 . . . . 0.0 112.211 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 57.9 30.01 18.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.762 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.488 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -104.5 135.38 19.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.046 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.69 125.89 18.4 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.412 2.074 . . . . 0.0 112.069 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.404 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -92.48 148.76 21.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.109 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.36 138.11 56.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.735 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -61.6 114.85 3.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.269 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.92 28.29 42.5 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.069 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.12 -178.92 5.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.883 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -106.73 -28.93 9.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.76 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -166.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.821 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.488 ' CD2' HG21 ' A' ' 60' ' ' ILE . 5.1 p80 -107.53 161.51 14.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.02 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 70' ' ' ILE . 6.9 mm -74.83 153.66 6.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.053 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -163.46 30.84 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.919 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -107.2 -178.99 3.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -84.46 -74.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -75.74 125.59 29.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 76' ' ' LEU . 46.6 mm -134.27 148.2 29.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.123 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.3 mp -105.38 106.97 17.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.465 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -90.93 114.98 27.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.784 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -148.94 163.47 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.115 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.739 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER 55.45 35.59 25.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.07 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 62.36 40.75 10.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -176.99 166.5 2.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.013 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -88.88 117.97 28.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.739 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 65.1 m95 -111.77 126.0 54.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.844 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.434 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -51.57 175.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.171 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -80.03 -40.69 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.283 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -91.08 -16.48 27.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.128 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -96.4 26.1 4.58 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.597 HD21 HG21 ' A' ' 28' ' ' ILE . 1.7 tp -128.62 29.24 5.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.996 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.38 150.26 21.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 4.3 t -60.46 125.25 22.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.816 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.29 -22.51 61.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.289 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -99.69 -63.08 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.735 0.302 . . . . 0.0 111.206 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.511 ' HB2' HG22 ' A' ' 95' ' ' VAL . 32.0 m -66.76 -32.31 73.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 59.07 23.35 11.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.102 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.511 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.1 m -90.82 149.34 40.17 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.153 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.82 118.95 5.8 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.561 2.174 . . . . 0.0 112.248 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.547 HD21 ' HB3' ' A' ' 110' ' ' CYS . 7.9 mp -111.04 63.05 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.78 39.49 1.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.188 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.754 ' C ' HD11 ' A' ' 28' ' ' ILE . 9.4 mt-10 -148.25 -49.18 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.587 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -136.52 174.2 10.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.628 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.8 t -156.98 156.15 32.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.504 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.7 OUTLIER -150.13 154.63 38.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 60.1 p -132.29 144.76 50.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.993 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.64 139.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.6 40.11 95.96 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.569 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 59.6 31.22 20.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -148.99 145.15 27.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.1 p -87.22 115.97 28.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.127 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.68 170.52 8.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.826 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.547 ' HB3' HD21 ' A' ' 97' ' ' LEU . 29.5 p -99.56 169.04 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.83 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 4.5 tttp -78.13 -29.79 49.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.267 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -53.42 -58.02 8.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.469 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.5 p30 -74.16 -20.94 60.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.314 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 13.5 t80 -63.65 -30.95 71.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.75 0.31 . . . . 0.0 110.926 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 5.1 m-85 -79.12 -39.21 34.21 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -85.07 -64.04 1.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.335 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -64.79 -48.62 73.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.64 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -102.01 36.89 1.98 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.332 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.94 -146.61 4.44 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.594 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.0 m -94.79 152.35 18.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 110.977 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.419 ' HZ3' ' HA ' ' A' ' 123' ' ' ALA . 0.0 OUTLIER -164.45 170.37 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.5 t -64.11 141.34 58.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.419 ' HA ' ' HZ3' ' A' ' 121' ' ' LYS . . . -94.74 27.14 3.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.121 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.24 -58.08 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.9 p -108.27 5.4 25.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.414 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 59.38 29.47 19.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.14 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.85 151.95 25.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.742 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -81.13 107.79 2.75 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.698 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.851 HG22 HD11 ' A' ' 15' ' ' LEU . 12.1 mt -70.41 130.92 88.7 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 110.52 -0.178 . . . . 0.0 110.52 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.643 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.5 Cg_exo -47.52 175.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.361 2.041 . . . . 0.0 112.23 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.7 Cg_endo -77.2 -49.91 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.471 2.114 . . . . 0.0 113.799 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.754 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -126.06 21.7 7.41 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.34 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.643 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -57.0 -168.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.68 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.777 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -123.59 108.9 21.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.936 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.697 ' HB ' HD11 ' A' ' 145' ' ' LEU . 12.4 p -152.67 158.87 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.065 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.481 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.86 135.92 38.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.793 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.93 135.0 47.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.975 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.619 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.31 96.57 2.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.939 0.399 . . . . 0.0 110.618 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.51 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.75 -86.33 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.4 -48.19 4.88 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.873 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -83.95 162.58 20.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.715 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.3 150.9 7.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.593 ' O ' HG21 ' A' ' 135' ' ' VAL . 23.0 m-85 -133.26 175.08 9.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.452 . . . . 0.0 111.37 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.31 161.84 22.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.046 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.777 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.6 mp -81.08 -30.2 34.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.149 0.5 . . . . 0.0 109.678 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -91.2 -49.26 6.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.665 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.7 m -53.87 -31.26 49.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.9 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.764 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.91 121.1 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.091 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.24 -177.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -100.92 150.14 23.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 152' ' ' VAL . 16.7 m -64.73 -26.87 41.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.263 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 151' ' ' VAL . 21.2 t -109.53 -55.9 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.338 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 m -65.86 -28.11 68.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.012 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 30.87 17.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.986 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -119.02 139.97 50.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.951 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.447 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.11 154.29 13.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.26 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.731 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.7 OUTLIER -116.57 107.32 14.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.538 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -90.17 172.28 8.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.681 HG23 ' HA2' ' A' ' 11' ' ' GLY . 7.9 m -43.01 132.29 4.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.734 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.35 -27.86 13.97 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.664 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.591 ' OD2' HD12 ' A' ' 157' ' ' LEU . 5.4 t0 -67.0 128.84 37.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.802 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.452 ' HA ' HG23 ' A' ' 9' ' ' VAL . 9.2 mt-10 -88.04 122.21 31.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.709 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -138.45 146.75 42.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.691 ' HB2' HG13 ' A' ' 172' ' ' VAL . 48.1 m-85 -101.58 151.47 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.619 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -107.65 110.96 22.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.797 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.5 mtp -69.4 161.23 29.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -62.7 -28.57 70.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.074 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -97.76 29.11 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.019 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.14 83.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.978 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.422 ' HE ' HG11 ' A' ' 151' ' ' VAL . 8.1 mtp180 -154.92 131.66 10.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.764 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 4.4 mp -83.62 128.21 34.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.691 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.4 p -145.11 122.45 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.082 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 20.4 m -58.38 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.412 ' HZ1' ' CD ' ' A' ' 162' ' ' GLU . 21.6 mttt -75.52 -57.05 4.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.84 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -33.6 70.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.108 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -72.98 -28.91 62.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -56.84 -66.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.946 0.403 . . . . 0.0 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.31 -49.73 75.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.942 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 67.5 m -59.43 -26.3 65.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.964 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -79.08 -51.98 8.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.252 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.74 -66.57 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.098 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.203 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.484 HG22 ' N ' ' A' ' 8' ' ' MET . 12.6 p . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.874 0.369 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.484 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.45 -173.64 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.595 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.3 p -151.82 147.69 15.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 161' ' ' ASP . 43.9 t -66.95 146.23 13.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.628 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.32 -157.9 9.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.572 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 0.0 OUTLIER -76.31 151.29 83.35 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.665 0.269 . . . . 0.0 110.815 -179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.777 ' HB2' HG12 ' A' ' 134' ' ' VAL . 2.6 Cg_endo -83.0 143.47 11.54 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.874 2.383 . . . . 0.0 112.417 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.57 142.92 8.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.344 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.559 HD21 ' CG1' ' A' ' 135' ' ' VAL . 7.7 mt -127.04 173.54 9.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 111.293 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.408 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -49.51 -50.49 41.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.793 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.583 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 62.69 80.82 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.457 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -160.27 -48.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.368 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 59.56 46.33 12.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 110.923 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE1' ' CD1' ' A' ' 115' ' ' PHE . 14.0 p90 -59.17 -179.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.929 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -173.54 -132.41 1.53 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.567 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.706 ' CB ' HD13 ' A' ' 27' ' ' LEU . 4.3 p-10 -55.21 -28.42 52.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.736 0.303 . . . . 0.0 111.16 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.35 -25.99 60.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.201 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.89 -70.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.073 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.3 tp10 -101.62 175.11 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 100.68 4.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 22' ' ' ASP . 2.9 tp -63.15 165.11 7.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.763 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.3 pt -62.9 148.49 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.5 m -107.74 106.78 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.82 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.19 101.82 9.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.435 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.86 154.02 40.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -78.63 157.05 28.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -110.6 102.31 10.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 41.3 p -60.18 86.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -150.32 -76.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 57.68 28.58 16.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.025 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -176.67 78.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.902 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 -179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.581 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.617 0.246 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 57' ' ' THR . 63.1 Cg_endo -73.43 163.96 36.34 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.49 2.127 . . . . 0.0 112.226 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 56.98 29.07 15.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.522 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.4 tp -99.1 134.89 21.02 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.077 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.2 Cg_endo -58.46 125.96 19.95 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.458 2.105 . . . . 0.0 112.097 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.19 140.12 29.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.057 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.3 p -58.36 164.22 2.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.93 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.437 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.98 114.59 24.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.445 179.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 125.09 -66.46 0.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.56 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -109.83 155.34 21.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.858 0.361 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -75.39 87.53 2.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.143 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.47 134.44 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.522 ' ND1' HG21 ' A' ' 60' ' ' ILE . 16.3 p-80 -72.77 141.05 48.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.478 ' HA ' HD13 ' A' ' 70' ' ' ILE . 5.6 mm -67.52 153.65 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.498 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.5 OUTLIER -172.55 35.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.864 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.82 145.83 38.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.179 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.0 110.84 18.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.853 0.359 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 76' ' ' LEU . 42.0 mm -121.67 153.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.211 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 75' ' ' ILE . 7.8 mp -109.61 106.75 16.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.305 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -91.03 116.36 28.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.964 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.763 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -157.13 165.63 35.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.163 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.805 HD12 ' NE1' ' A' ' 83' ' ' TRP . 3.0 mt 59.09 36.43 24.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.072 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 62.3 34.42 15.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.023 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -176.45 178.57 1.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.917 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -94.41 126.85 39.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.913 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.805 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.7 m95 -116.86 132.73 56.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.08 171.55 0.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.07 -40.21 28.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.089 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 pttp -90.95 -28.18 18.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.127 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 57.7 m -67.6 -30.62 70.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 83' ' ' TRP . 1.6 tp -81.12 94.12 6.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -155.35 154.53 32.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.933 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 147.03 38.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.7 t -72.78 -31.27 64.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.916 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -97.28 -59.97 1.68 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.977 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 45.7 m -60.02 -34.47 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 57.37 22.46 7.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.056 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -84.63 156.65 61.74 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.048 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.9 118.9 5.94 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.522 2.148 . . . . 0.0 112.246 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.583 HD23 ' SG ' ' A' ' 101' ' ' CYS . 7.4 mp -103.24 71.03 1.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -106.07 30.91 5.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -148.55 -49.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.617 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -142.99 128.99 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.583 ' SG ' HD23 ' A' ' 97' ' ' LEU . 1.5 t -123.83 171.09 9.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.6 m-85 -156.32 151.5 26.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.518 ' OG ' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -151.65 140.05 20.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -150.01 123.97 9.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.23 -88.64 1.59 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.506 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.02 35.86 0.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.447 ' HB2' ' CE1' ' A' ' 109' ' ' TYR . 48.9 m -150.73 -175.02 4.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 102' ' ' PHE . 11.7 p -136.97 116.0 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.082 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 107' ' ' SER . 1.3 m-85 -116.69 173.24 6.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.9 p -89.13 178.31 6.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 12.3 ttmt -73.65 -48.97 28.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.91 -30.55 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.218 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -84.04 -21.64 31.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.319 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 12.9 t80 -69.52 -41.17 76.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 6.6 m-85 -66.78 -36.8 83.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.921 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.36 -44.4 13.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.25 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -78.94 -50.92 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.244 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -108.67 37.02 2.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.59 165.25 33.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.444 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.795 HG22 HG11 ' A' ' 142' ' ' VAL . 1.6 m -57.85 151.08 18.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.757 0.313 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -163.3 159.43 22.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.167 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 124' ' ' ALA . 43.3 t -74.2 135.76 42.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.787 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.66 34.21 1.9 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 122' ' ' CYS . . . -125.12 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.096 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.5 p -109.9 12.54 23.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.411 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.7 mp0 55.5 30.84 15.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.754 0.311 . . . . 0.0 111.04 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -103.49 130.49 50.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.96 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.98 131.19 51.93 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.444 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.585 HG23 ' HD2' ' A' ' 130' ' ' PRO . 51.9 mt -79.25 140.06 56.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.922 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.589 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 92.7 Cg_exo -44.83 171.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.833 2.355 . . . . 0.0 112.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -77.37 -55.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.588 2.192 . . . . 0.0 114.807 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.583 HG23 ' CA ' ' A' ' 17' ' ' GLY . 1.6 m -126.55 21.46 7.13 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.589 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 82.9 mm-40 -61.42 -176.04 0.07 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.777 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.65 116.49 49.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.973 0.416 . . . . 0.0 111.167 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.559 ' CG1' HD21 ' A' ' 15' ' ' LEU . 8.8 p -157.06 162.96 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.538 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.22 142.17 28.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.016 0.436 . . . . 0.0 110.857 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.427 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.6 OUTLIER -116.05 123.64 48.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.836 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.517 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -57.43 96.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.077 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.439 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 52.98 -87.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.223 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 138' ' ' ALA . 6.5 t0 -96.64 -47.13 6.03 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.988 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.88 157.31 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.083 0.468 . . . . 0.0 111.746 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.795 HG11 HG22 ' A' ' 120' ' ' THR . 7.6 p -107.68 149.51 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.621 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -131.92 163.24 28.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.008 0.432 . . . . 0.0 111.403 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -63.59 165.38 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.964 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.64 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.2 mp -81.03 -32.76 33.99 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -91.34 -49.26 6.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.903 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.425 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 80.8 m -50.44 -38.93 46.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.795 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.5 t80 -56.91 118.38 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.233 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.09 179.24 2.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.048 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -85.33 150.09 25.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.971 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 152' ' ' VAL . 8.2 m -72.17 -34.64 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.144 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -102.95 -51.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 14.0 m -66.02 -28.05 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.982 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm 57.79 40.71 25.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.132 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -128.96 143.16 50.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.972 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.701 ' C ' HD22 ' A' ' 157' ' ' LEU . 13.9 mp0 -61.35 172.36 1.15 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.954 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 156' ' ' GLN . 1.8 mm? -127.45 164.62 21.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 158.91 43.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.4 t -43.01 129.46 4.44 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.619 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.75 -27.95 16.85 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.553 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.545 ' O ' HG23 ' A' ' 10' ' ' VAL . 30.1 m-20 -70.27 129.13 38.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.772 0.32 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -89.31 114.92 26.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.972 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.2 p90 -129.64 152.05 49.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 23.0 m-85 -101.48 139.31 37.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.739 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.517 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -99.94 127.09 46.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.707 179.793 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.4 mmt -90.66 161.92 15.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.039 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -23.6 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -96.05 27.45 3.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.093 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.06 30.09 15.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.099 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 154.52 19.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.862 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.795 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -109.25 121.73 45.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.024 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.456 HG13 ' O ' ' A' ' 172' ' ' VAL . 7.6 p -145.08 121.67 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.002 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 21.7 p -76.07 -169.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -43.39 54.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.283 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.05 -52.25 61.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.6 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -84.98 4.06 35.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.64 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.0 t80 -67.53 -66.11 0.6 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.881 0.372 . . . . 0.0 110.83 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.13 -23.53 65.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 75.2 m -84.64 -32.75 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.046 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -89.91 -29.66 18.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.284 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 61.79 175.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.965 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.617 HG23 ' CE1' ' A' ' 164' ' ' TYR . 12.5 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.789 0.328 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.66 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.11 178.73 6.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.663 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' A' ' 162' ' ' GLU . 9.4 p -154.96 135.39 4.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.248 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' CD1' ' A' ' 163' ' ' PHE . 61.4 t -53.54 146.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.592 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.585 ' C ' HG23 ' A' ' 159' ' ' THR . . . -139.35 -148.63 5.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.657 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 13' ' ' PRO . 25.3 mt-10 -72.98 115.28 38.74 Favored Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 122.906 -0.173 . . . . 0.0 110.73 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.558 ' O ' HG12 ' A' ' 134' ' ' VAL . 27.2 Cg_endo -62.3 135.41 53.91 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.251 1.967 . . . . 0.0 112.213 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.23 167.9 27.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.42 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 129' ' ' ILE . 1.4 mt -143.99 173.91 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.226 0.536 . . . . 0.0 111.746 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.427 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.96 -35.99 71.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.501 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.824 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.99 94.78 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.589 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.43 103.33 0.31 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.298 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 16.5 mt-10 -50.91 -71.71 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 111.069 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' HB2' ' CE1' ' A' ' 115' ' ' PHE . 29.0 t80 -176.94 -66.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.91 120.97 1.41 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.489 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.95 -44.22 14.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -29.69 68.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.79 -31.34 68.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.962 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 6.6 tp10 -109.23 160.68 15.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.933 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.29 101.92 5.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.901 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.643 HD11 ' HB3' ' A' ' 100' ' ' ARG . 0.7 OUTLIER -76.89 164.95 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.85 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.795 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.8 pt -62.95 147.88 11.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.22 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -114.88 106.91 14.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.757 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.77 101.83 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.626 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -145.65 146.86 31.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.947 -179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -75.4 147.75 39.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -104.87 160.14 15.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.6 t -98.7 32.56 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -105.63 78.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -94.23 -33.32 13.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.912 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -131.86 82.23 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.079 -179.971 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.665 0.269 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.12 164.57 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.542 2.161 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 59.5 30.81 20.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.925 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.517 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.6 tp -103.81 134.75 19.56 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.034 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.455 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.3 Cg_endo -58.72 125.93 19.73 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.415 2.077 . . . . 0.0 112.056 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.33 138.51 31.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.13 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.565 ' HA ' ' CE1' ' A' ' 82' ' ' HIS . 13.8 p -57.98 164.27 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.86 114.66 24.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.501 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.59 -71.1 0.45 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.527 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 13.6 p -103.59 153.07 21.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.826 0.346 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -74.03 87.04 1.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -179.05 137.74 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' HD23 ' A' ' 71' ' ' LEU . 15.9 p-80 -76.53 145.8 38.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -73.53 153.76 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.535 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -172.94 35.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.961 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.425 ' HB2' HD11 ' A' ' 75' ' ' ILE . 3.9 m-20 -110.59 159.61 17.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -60.11 -75.25 0.06 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -74.86 112.12 10.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.444 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.3 mm -120.93 152.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.226 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.9 mp -111.79 106.78 15.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -90.81 128.01 36.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.795 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -161.48 158.95 27.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.261 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.677 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.6 OUTLIER 59.57 38.45 22.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.09 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 61.43 29.32 18.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -173.9 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.866 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.565 ' CE1' ' HA ' ' A' ' 63' ' ' CYS . 34.9 p80 -105.34 124.31 49.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.677 ' NE1' HD12 ' A' ' 79' ' ' LEU . 49.3 m95 -112.37 130.77 55.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.714 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.569 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.14 171.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.1 -39.98 28.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.003 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -91.03 -29.79 17.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 74.6 m -67.13 -30.73 70.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.957 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.464 ' CD2' HG21 ' A' ' 28' ' ' ILE . 1.6 tp -69.5 90.61 0.55 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -148.42 148.27 30.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.846 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.8 t -58.13 147.04 31.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 t -74.75 -29.1 61.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.252 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.847 0.356 . . . . 0.0 111.16 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.437 ' HB2' HG22 ' A' ' 95' ' ' VAL . 15.9 m -61.7 -32.57 72.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.053 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 54.15 24.73 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.129 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.437 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -83.9 146.7 49.67 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.138 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.63 118.99 5.69 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.533 2.155 . . . . 0.0 112.268 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -114.32 108.66 17.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.88 30.99 2.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.174 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.743 ' C ' HD11 ' A' ' 28' ' ' ILE . 12.0 mt-10 -139.78 -47.08 0.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.643 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -134.43 174.21 10.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.762 ' HB2' HG23 ' A' ' 28' ' ' ILE . 48.0 t -157.0 127.98 6.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.948 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 50.2 t80 -129.93 120.64 25.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.482 ' OG ' HD22 ' A' ' 79' ' ' LEU . 93.2 p -138.0 156.1 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.5 mtt85 -154.03 124.43 7.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.931 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.18 -54.15 4.22 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.532 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -176.33 -42.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.331 . . . . 0.0 110.88 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -78.73 151.29 32.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.832 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 108' ' ' VAL . 13.0 p -114.12 122.75 68.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.049 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -145.54 133.08 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 17.9 p -55.59 148.38 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 1.8 mtmp? -64.09 -19.98 65.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 t0 -46.62 -58.07 4.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.818 0.342 . . . . 0.0 111.323 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -77.68 -20.62 53.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.075 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.505 ' CZ ' ' CD2' ' A' ' 118' ' ' PHE . 11.1 t80 -58.16 -27.89 64.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.899 0.381 . . . . 0.0 110.695 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 1.9 m-85 -73.04 -28.77 62.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -82.31 -31.8 29.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.503 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.438 ' HD3' ' CE2' ' A' ' 118' ' ' PHE . 9.1 ptp180 -88.57 -37.25 15.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.443 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.505 ' CD2' ' CZ ' ' A' ' 114' ' ' PHE . 93.9 m-85 -103.36 -43.11 5.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.888 0.375 . . . . 0.0 111.151 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -70.31 170.83 44.37 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.468 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 71.5 m -58.65 152.36 18.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 110.805 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -138.65 172.33 13.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.037 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.499 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -85.27 129.61 34.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.51 30.62 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.034 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.848 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.08 -56.17 1.56 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.7 p -107.83 -20.12 13.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.162 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 68.63 70.74 0.29 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.84 0.353 . . . . 0.0 110.868 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 127' ' ' LEU . 3.9 tp -130.28 -165.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.842 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -105.48 99.35 1.56 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.678 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.705 HG23 HE21 ' A' ' 133' ' ' GLN . 16.1 mt -75.73 125.59 88.23 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.47 0.176 . . . . 0.0 110.719 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.613 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.8 Cg_exo -51.62 -180.0 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.141 1.894 . . . . 0.0 111.96 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 74.4 Cg_endo -77.32 -49.39 0.1 Allowed 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.398 2.065 . . . . 0.0 113.818 -179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.824 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.8 21.72 7.58 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.705 HE21 HG23 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -55.71 146.47 21.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.277 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.558 HG12 ' O ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -88.87 108.92 19.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.998 0.427 . . . . 0.0 111.028 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.516 HG12 ' HG ' ' A' ' 15' ' ' LEU . 12.0 p -153.25 159.33 3.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.105 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.493 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.77 137.64 35.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.666 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.477 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.1 OUTLIER -105.01 150.86 24.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.852 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -92.43 96.49 10.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.698 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 51.86 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.178 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.413 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -93.57 -46.88 7.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.843 -177.908 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 7.9 m-85 -87.27 166.92 14.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.679 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.477 HG23 ' CG ' ' A' ' 137' ' ' ARG . 7.3 p -119.82 127.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.785 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.848 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 4.3 m-85 -110.06 134.78 51.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.989 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 71.1 m80 -59.52 138.95 57.53 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.853 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.41 HD23 ' OE1' ' A' ' 133' ' ' GLN . 0.8 OUTLIER -60.43 -19.64 57.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -85.06 -37.88 19.8 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.9 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.7 p -98.16 12.88 33.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.852 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 3.4 t80 -86.14 121.92 29.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.735 0.302 . . . . 0.0 110.832 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.98 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.122 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 150.08 24.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 152' ' ' VAL . 4.7 m -66.08 -30.32 49.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.114 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 151' ' ' VAL . 27.9 t -111.81 -52.2 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.108 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 15.3 m -65.99 -28.05 68.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt 57.66 32.58 22.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.998 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -111.93 133.96 53.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.625 ' O ' HD13 ' A' ' 157' ' ' LEU . 6.0 mt-30 -62.3 157.91 18.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.124 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.735 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -126.74 125.41 41.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -104.05 177.73 4.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.409 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.585 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.1 m -45.61 129.31 8.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.668 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.88 -27.09 15.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.792 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.58 128.97 39.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.76 0.314 . . . . 0.0 110.793 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.543 ' HA ' HG23 ' A' ' 9' ' ' VAL . 40.2 mt-10 -87.91 129.61 35.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.039 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.66 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 10.9 p90 -150.75 154.13 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.006 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.617 ' CE1' HG23 ' A' ' 7' ' ' VAL . 19.6 m-85 -106.46 171.02 7.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.852 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -128.47 111.03 12.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.827 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.91 -178.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.947 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -27.52 33.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -97.5 29.68 3.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.076 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.48 83.63 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.413 ' HB3' HG11 ' A' ' 151' ' ' VAL . 8.6 mtp180 -150.37 147.12 27.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.852 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.99 121.03 32.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.407 ' O ' HG13 ' A' ' 172' ' ' VAL . 9.4 p -145.09 126.39 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.949 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.1 p -78.07 -175.39 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.818 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -78.57 -26.94 45.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.13 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.94 78.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.35 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -103.92 -4.51 23.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.673 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -56.99 -66.19 0.49 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.75 -27.2 64.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.873 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 -39.75 61.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.12 4.05 51.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.599 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.04 -177.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.957 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.621 HG23 ' CE1' ' A' ' 164' ' ' TYR . 11.0 p . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.848 0.356 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.486 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -112.45 -176.94 3.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.643 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.462 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.1 p -155.14 136.53 5.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.345 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.3 t -61.38 145.54 12.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.649 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.14 -171.07 13.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.429 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.6 mt-10 -61.03 149.19 82.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.932 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.0 Cg_endo -78.27 138.79 16.21 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.593 2.195 . . . . 0.0 112.373 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -164.11 142.91 7.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.265 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -119.82 173.54 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.129 0.49 . . . . 0.0 111.455 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.469 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.44 -36.13 82.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.801 179.851 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.882 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.53 98.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.544 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.33 -76.95 0.12 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.568 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 61.05 77.37 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.785 0.326 . . . . 0.0 110.837 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.513 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 11.1 p90 -59.43 -39.51 83.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 65.17 179.77 8.05 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.638 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.555 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.9 p30 -57.63 -21.98 42.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.692 0.282 . . . . 0.0 111.195 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -54.45 -27.62 38.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -77.91 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.943 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 53.6 tp10 -92.75 156.28 17.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.991 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -76.02 100.05 4.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.839 HD21 ' HG2' ' A' ' 100' ' ' ARG . 2.4 tp -65.22 160.15 22.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 88' ' ' LEU . 1.6 pt -63.0 141.29 18.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.9 m -115.96 106.97 14.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.752 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -78.47 101.91 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.794 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.469 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -141.94 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.965 -179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -69.22 156.96 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -100.78 -170.07 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -98.83 -33.29 10.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.64 173.13 1.8 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.423 ' CE2' ' HD3' ' A' ' 73' ' ' ARG . 0.7 OUTLIER -176.24 -43.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -128.49 31.55 4.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.911 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.103 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.653 0.263 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.73 161.86 41.92 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.528 2.152 . . . . 0.0 112.191 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 59.73 31.18 20.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.721 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -104.72 134.73 19.51 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.046 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.8 Cg_endo -60.8 125.94 18.46 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.405 2.07 . . . . 0.0 112.102 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.71 140.44 32.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 p -57.59 164.2 2.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.0 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -85.12 114.67 22.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.569 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.13 -72.82 0.38 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.558 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.3 p -100.72 154.04 18.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.785 0.326 . . . . 0.0 110.962 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -76.03 86.22 2.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.158 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.04 127.63 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.721 ' CD2' HG21 ' A' ' 60' ' ' ILE . 10.1 p80 -63.97 161.84 15.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.933 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.574 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.8 mm -94.5 153.09 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.968 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.574 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -162.12 30.34 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.921 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -103.67 176.16 5.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.934 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.423 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -83.06 -78.32 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.708 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.26 97.37 0.93 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.755 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.633 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.9 141.34 20.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.633 ' H ' HD13 ' A' ' 75' ' ' ILE . 8.6 mp -89.81 106.98 18.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.621 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -90.9 115.53 28.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.752 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -157.02 158.93 37.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.261 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.789 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 59.33 36.77 23.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.077 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.18 30.22 17.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -168.22 178.77 4.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.452 ' HB2' HD12 ' A' ' 75' ' ' ILE . 27.3 p-80 -96.56 125.05 40.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.789 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.8 m95 -113.72 133.21 55.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.772 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.456 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.69 173.1 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -79.99 -40.65 27.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -90.97 -30.71 16.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -67.3 -31.03 71.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.983 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 28' ' ' ILE . 22.8 tp -71.7 81.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -138.55 164.11 30.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.14 146.89 43.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.925 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.17 -27.41 68.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.059 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -111.73 -57.77 2.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.038 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -59.25 -45.17 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.068 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 61.09 23.25 13.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.1 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.505 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 m -86.57 157.77 55.05 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.164 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.14 118.96 5.93 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.482 2.121 . . . . 0.0 112.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 95' ' ' VAL . 7.1 mp -110.05 35.95 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.659 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.54 -17.82 63.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.559 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.816 ' C ' HD11 ' A' ' 28' ' ' ILE . 14.6 mt-10 -91.35 -55.34 3.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.755 0.312 . . . . 0.0 110.987 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.839 ' HG2' HD21 ' A' ' 27' ' ' LEU . 1.4 mpt_? -142.6 160.97 39.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.849 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.577 ' HB3' HG23 ' A' ' 28' ' ' ILE . 52.8 t -157.06 127.95 6.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.532 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.5 OUTLIER -105.89 160.63 15.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -139.75 157.62 45.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 109' ' ' TYR . 2.8 mmp_? -141.31 172.06 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.818 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.78 68.48 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.566 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -90.08 -71.1 0.63 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.784 0.326 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.06 -173.23 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.972 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.5 p -99.5 123.33 52.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.16 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.421 ' CE2' ' HG3' ' A' ' 104' ' ' ARG . 1.1 m-85 -121.49 161.57 22.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 15.1 p -82.92 168.38 17.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.713 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 1.0 OUTLIER -57.9 -35.99 71.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.022 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.437 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 4.4 t70 -76.33 -23.6 54.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.194 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.6 -21.06 49.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.407 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.513 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 11.6 t80 -67.64 -44.89 76.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.813 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.497 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 17.3 m-85 -59.6 -42.89 93.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.871 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.71 -28.01 40.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.5 mmt-85 -78.08 -54.97 5.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.217 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -110.88 -43.06 3.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.168 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.15 168.88 3.89 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.636 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 84.8 m -65.3 153.26 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.741 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.24 162.1 37.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.555 ' CA ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -77.94 128.67 34.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.34 30.67 3.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.04 -49.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 30.9 p -116.57 -0.92 12.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.421 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 127' ' ' LEU . 2.2 mp0 62.6 69.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.922 0.391 . . . . 0.0 110.928 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 126' ' ' GLN . 1.1 mp -146.83 143.0 28.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.778 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.4 104.34 1.84 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.702 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.555 HD11 ' CA ' ' A' ' 122' ' ' CYS . 1.7 mp -72.07 138.23 82.0 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.507 0.194 . . . . 0.0 110.708 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 94.6 Cg_exo -43.08 171.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.746 2.297 . . . . 0.0 112.844 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.39 -55.2 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.835 2.357 . . . . 0.0 113.828 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.882 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.95 21.46 7.52 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.243 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.604 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.5 OUTLIER -63.43 139.11 58.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.484 179.768 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.932 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -73.44 108.76 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.039 0.447 . . . . 0.0 111.007 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.7 p -146.11 160.47 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.85 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.514 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.32 134.85 38.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.45 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -114.13 130.57 56.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.923 -179.576 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -66.59 96.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.72 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.76 -88.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.491 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 138' ' ' ALA . 19.4 p-10 -89.24 -43.89 10.66 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.879 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CD2' ' OD1' ' A' ' 140' ' ' ASP . 5.8 m-85 -89.32 164.14 15.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.989 0.423 . . . . 0.0 111.682 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.486 ' CG1' HD13 ' A' ' 129' ' ' ILE . 9.3 p -114.04 149.33 16.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.71 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -132.3 174.91 9.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.383 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.412 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 47.2 m80 -98.22 144.21 27.9 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.879 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.655 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -63.01 -17.92 62.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.389 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.25 -47.95 7.2 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.798 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -84.4 -31.61 24.6 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.676 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.855 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 31.7 t80 -56.84 110.19 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.351 . . . . 0.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -161.17 -176.97 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.074 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.5 150.03 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.019 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 171' ' ' LEU . 11.7 m -64.73 -29.42 47.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.749 HG23 HG23 ' A' ' 151' ' ' VAL . 21.1 t -110.9 -51.6 6.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.184 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 38.4 m -65.94 -28.09 68.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm 53.15 30.6 10.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -111.1 140.03 45.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.431 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.9 mp0 -61.78 156.17 21.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.901 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.708 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -117.88 168.11 10.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.844 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.1 168.85 19.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.022 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.6 t -47.96 126.69 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.26 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.47 -25.27 27.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.736 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.462 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.3 t70 -66.63 128.82 37.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.698 0.285 . . . . 0.0 110.656 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -91.38 119.07 31.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.19 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.643 ' CD2' HD23 ' A' ' 171' ' ' LEU . 3.4 p90 -138.71 164.6 29.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.837 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.621 ' CE1' HG23 ' A' ' 7' ' ' VAL . 76.8 m-85 -112.63 156.84 22.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.862 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.525 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -116.19 113.33 22.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.7 mmt -58.13 177.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -58.28 -49.02 78.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.993 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -74.3 -78.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 40.7 p -177.24 37.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.796 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -93.3 144.93 24.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.855 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -94.59 120.96 35.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.603 HG13 ' HB2' ' A' ' 164' ' ' TYR . 10.0 p -139.73 130.58 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.068 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.6 p -86.13 -172.4 4.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.428 ' NZ ' HG21 ' A' ' 7' ' ' VAL . 1.1 mptp? -63.75 -57.76 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.032 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.38 -29.44 48.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.297 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.472 ' CB ' HG23 ' A' ' 172' ' ' VAL . 58.1 m-20 -90.04 -23.46 21.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.467 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.3 t80 -56.12 -66.12 0.48 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.953 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.26 -44.91 94.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 65.9 m -61.26 -31.5 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -76.07 -51.35 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.69 -67.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' GLN . . . . . 0.421 ' HB3' ' CE2' ' A' ' 177' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.875 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.491 HG22 ' N ' ' A' ' 8' ' ' MET . 12.1 p . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.873 0.368 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.558 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.62 -176.94 6.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.558 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -150.77 150.61 13.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.352 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.737 HG21 ' HB3' ' A' ' 157' ' ' LEU . 24.3 t -66.92 146.42 13.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.831 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.7 -179.65 16.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.385 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -57.4 139.39 80.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.475 0.179 . . . . 0.0 110.678 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.651 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.84 140.49 61.38 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.364 2.043 . . . . 0.0 112.493 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -166.14 142.94 5.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.257 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.801 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -114.89 173.26 6.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.079 0.466 . . . . 0.0 111.333 -179.553 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.635 ' HE3' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -62.77 -34.35 77.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.788 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.851 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.18 65.23 3.66 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.417 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -153.6 82.22 0.17 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.622 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -84.2 5.05 27.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.547 0.213 . . . . 0.0 111.225 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 2.9 m-85 69.89 -67.04 0.25 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.36 133.88 3.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.597 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.02 -30.39 26.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.904 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.88 -31.15 71.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.52 -75.09 0.05 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG2' ' CD1' ' A' ' 102' ' ' PHE . 9.1 tp10 -60.06 165.37 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.878 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -75.91 99.95 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.719 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 100' ' ' ARG . 3.1 tp -86.0 165.0 17.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.012 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.854 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.96 149.92 9.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.9 m -122.59 106.88 11.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.796 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -80.62 101.76 9.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.505 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.17 166.04 27.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.036 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -81.26 157.04 25.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.96 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -102.78 174.47 5.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 p -103.0 35.92 2.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -128.4 161.73 28.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -166.25 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -150.61 80.22 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.12 179.989 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.757 0.313 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.03 168.98 19.03 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.527 2.151 . . . . 0.0 112.156 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 57.85 29.88 18.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.866 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.437 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.1 tp -98.69 135.18 21.12 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.056 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.3 Cg_endo -60.35 125.87 18.58 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.35 2.034 . . . . 0.0 111.964 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -102.71 151.14 22.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.153 -179.622 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.451 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 4.5 t -58.16 137.73 56.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.787 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -62.5 114.65 3.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.172 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.05 25.68 39.81 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.11 -178.9 4.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.931 0.396 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -112.76 -30.74 6.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.182 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.95 -168.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.063 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 62' ' ' MET . 2.1 p80 -102.36 172.42 6.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.655 ' C ' HD23 ' A' ' 71' ' ' LEU . 12.8 mm -98.06 154.13 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.297 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.655 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -167.02 32.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.68 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -99.17 -179.06 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.894 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.25 -67.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.55 133.65 33.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.067 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.435 ' C ' HD12 ' A' ' 76' ' ' LEU . 41.9 mm -138.89 151.42 23.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.111 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 76' ' ' LEU . 6.2 mp -105.05 106.95 17.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.528 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -90.96 115.02 27.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -147.75 159.4 43.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.071 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.527 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.33 36.1 24.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.076 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.47 39.59 11.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -174.03 162.89 3.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.451 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 43.1 p-80 -86.79 117.88 25.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.959 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.527 ' NE1' HD12 ' A' ' 79' ' ' LEU . 86.0 m95 -108.09 124.6 50.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.74 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.09 174.45 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.964 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -80.06 -38.37 32.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.353 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -91.19 -22.17 20.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.958 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.7 m -95.53 26.76 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.854 HD21 HG21 ' A' ' 28' ' ' ILE . 56.0 tp -129.89 88.68 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.835 0.35 . . . . 0.0 111.023 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 161.54 37.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -59.02 147.0 36.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -75.6 -31.07 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -95.8 -60.6 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -60.25 -34.83 74.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.873 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 58.19 31.15 20.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.014 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.467 ' O ' HD13 ' A' ' 97' ' ' LEU . 17.0 t -97.86 133.01 23.8 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.1 118.97 3.1 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.542 2.162 . . . . 0.0 112.557 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 95' ' ' VAL . 5.6 mp -101.86 77.47 1.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.825 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -108.92 38.15 2.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -152.68 -66.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.611 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -127.04 133.86 50.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.736 ' SG ' HD11 ' A' ' 88' ' ' LEU . 1.9 t -123.36 128.04 49.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.907 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.418 ' CD1' ' HG2' ' A' ' 25' ' ' GLU . 0.4 OUTLIER -112.35 153.64 26.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.2 t -127.43 117.82 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.881 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -149.71 123.96 9.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.47 50.22 45.39 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.482 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 68.91 -67.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 m -58.43 151.2 20.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.952 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.06 134.76 27.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.047 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -122.94 156.38 34.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.937 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.4 p -112.78 135.94 52.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.692 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.447 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -51.97 -35.57 46.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.188 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -45.14 -48.89 12.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.45 -20.8 33.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.85 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.46 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 11.1 t80 -64.13 -34.96 79.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.447 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 40.6 m-85 -65.11 -40.94 95.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.93 0.395 . . . . 0.0 110.756 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -74.8 -56.52 4.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.311 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -73.49 -51.92 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.468 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 96.6 m-85 -98.53 37.01 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.203 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.99 -143.71 3.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.635 ' HB ' ' HE3' ' A' ' 16' ' ' MET . 80.7 m -103.07 155.0 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.711 0.291 . . . . 0.0 110.814 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -151.62 158.42 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.875 0.369 . . . . 0.0 111.191 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.468 ' HA ' HD11 ' A' ' 129' ' ' ILE . 52.1 t -74.28 136.78 42.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.722 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.46 30.23 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.23 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -58.15 1.47 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 18.0 p -110.37 18.2 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.211 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 54.41 28.37 9.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.778 0.323 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.426 HD23 ' CE1' ' A' ' 144' ' ' HIS . 14.4 tp -100.86 134.71 43.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.829 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.0 110.87 3.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.625 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.786 HG22 HD11 ' A' ' 15' ' ' LEU . 11.4 mt -63.7 139.56 97.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.555 0.216 . . . . 0.0 110.895 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.573 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 91.9 Cg_exo -44.59 172.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.672 2.248 . . . . 0.0 112.598 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.09 -55.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.908 2.405 . . . . 0.0 114.464 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.851 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.32 21.39 7.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.573 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 67.0 mm-40 -61.22 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.471 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.768 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -118.81 112.16 36.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.946 0.403 . . . . 0.0 111.079 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.801 HG12 ' HG ' ' A' ' 15' ' ' LEU . 8.7 p -157.05 161.39 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.733 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.531 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.25 134.92 38.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.639 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.837 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -113.91 136.57 52.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.811 -179.73 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -72.68 96.32 1.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.861 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.438 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 38.1 -89.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.2 m-20 -79.05 -38.5 36.3 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.205 -177.258 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.41 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.7 m-85 -105.84 168.19 9.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.837 HG22 ' CB ' ' A' ' 137' ' ' ARG . 46.9 t -122.58 148.12 26.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.514 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.572 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.9 m-85 -133.56 170.18 15.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.118 0.485 . . . . 0.0 111.733 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 0.1 OUTLIER -65.83 168.78 7.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.907 179.729 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.768 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.5 mp -81.04 -29.96 34.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 177.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -91.42 -49.3 6.41 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.11 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 79.7 m -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.245 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.675 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.6 t80 -56.84 114.58 2.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.021 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.1 -177.02 1.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 153' ' ' CYS . 30.6 t -97.68 150.07 21.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 152' ' ' VAL . 21.3 m -66.81 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -106.22 -55.88 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.345 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 150' ' ' CYS . 25.8 m -65.84 -28.19 68.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.005 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? 54.73 31.65 15.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.69 146.83 46.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.855 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.6 mp0 -62.19 154.13 28.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.737 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.7 mm? -112.16 123.27 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -98.88 157.67 16.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.0 t -44.69 133.51 5.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.26 -32.98 6.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.628 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.519 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -67.15 131.06 45.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 0.0 110.812 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.04 113.89 24.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.031 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.784 ' CD2' HD23 ' A' ' 171' ' ' LEU . 9.0 p90 -126.49 153.27 45.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.927 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m-85 -102.16 163.27 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.743 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.6 tp -120.7 112.11 18.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.801 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.14 167.85 2.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.36 -29.65 67.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.5 -79.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.038 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.43 38.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.823 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -105.54 117.58 34.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.784 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -69.4 127.22 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.07 126.66 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.056 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.1 m -58.77 -170.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.811 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -73.42 -55.86 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.71 -43.91 97.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.101 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -59.37 -25.76 64.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.056 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -55.83 -66.09 0.48 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.999 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -56.44 -28.14 58.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.118 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -30.5 43.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.985 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -90.45 -29.18 18.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.246 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm 61.88 174.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.847 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.853 -179.917 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.491 HG22 ' N ' ' A' ' 8' ' ' MET . 10.9 p . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.845 0.355 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -139.51 -177.4 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.639 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.443 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.9 p -155.06 135.7 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.227 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' A' ' 163' ' ' PHE . 57.5 t -58.9 146.17 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.01 -153.18 8.7 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.664 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 60.0 mt-10 -67.66 141.51 95.19 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.534 0.207 . . . . 0.0 110.748 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.604 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.0 Cg_endo -83.03 129.91 5.48 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.716 2.277 . . . . 0.0 112.396 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -156.43 155.17 31.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.349 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.558 HD21 ' CG1' ' A' ' 135' ' ' VAL . 8.2 mt -136.28 173.38 11.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.874 0.369 . . . . 0.0 111.091 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.409 ' HE3' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.66 -50.66 32.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.777 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.857 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 63.13 88.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.583 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.98 -41.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.424 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 58.4 23.27 10.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.75 0.31 . . . . 0.0 111.026 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 56.95 -172.91 0.08 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.872 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.18 136.76 7.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.89 -31.23 61.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.748 0.308 . . . . 0.0 110.854 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.15 -27.9 61.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.038 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -56.31 -31.18 63.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.025 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.7 OUTLIER -113.01 174.19 6.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -75.98 121.61 22.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.834 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 100' ' ' ARG . 3.1 tp -105.13 163.68 12.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.839 HG23 ' HB2' ' A' ' 101' ' ' CYS . 8.3 pt -63.04 146.31 12.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.139 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.402 HG22 ' HG ' ' A' ' 31' ' ' LEU . 50.3 m -113.46 106.84 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.833 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -77.08 101.75 6.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.491 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.03 155.9 42.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.968 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -77.72 152.35 33.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -99.24 -27.52 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.409 ' O ' HG22 ' A' ' 34' ' ' THR . 8.8 m 63.37 37.56 10.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.817 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -124.44 73.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.836 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE2' ' NH1' ' A' ' 73' ' ' ARG . 2.2 t80 -70.55 -44.4 67.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -102.06 141.32 35.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.068 179.957 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 120.638 0.256 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.47 165.53 1.02 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.558 2.172 . . . . 0.0 112.265 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 59.71 31.16 20.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.447 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -106.29 134.93 19.56 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.053 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.6 Cg_endo -60.14 125.9 18.79 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.405 2.07 . . . . 0.0 112.031 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.5 mtt -99.19 135.94 39.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.43 ' HB2' ' CG1' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -58.03 147.54 29.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.654 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.486 ' HB1' ' CE3' ' A' ' 83' ' ' TRP . . . -62.12 114.82 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.068 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 97.37 -22.24 41.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.967 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.76 -178.82 6.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -144.4 46.88 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.01 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -150.68 -83.35 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.014 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 176.03 -177.55 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.933 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.688 ' C ' HD23 ' A' ' 71' ' ' LEU . 7.7 mm -126.93 153.72 36.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.688 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -172.79 35.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.886 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HB2' HD11 ' A' ' 75' ' ' ILE . 23.8 m-20 -100.3 -179.54 4.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' NH1' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -81.73 -79.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.548 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.4 OUTLIER -77.92 132.75 38.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.548 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.5 mm -136.03 152.48 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.115 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.0 mp -106.97 106.91 17.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.437 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -90.84 120.83 32.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.677 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.87 154.75 34.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.114 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.883 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.74 37.72 28.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.21 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.72 40.68 12.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.911 0.386 . . . . 0.0 111.145 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -176.64 159.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.822 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.44 ' CD2' HG13 ' A' ' 70' ' ' ILE . 29.9 p-80 -85.17 117.93 24.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.883 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 77.9 m95 -106.93 122.92 47.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.608 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.482 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.98 151.84 11.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.894 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -59.01 -35.89 74.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.843 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mttt -91.15 -48.9 6.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.94 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 21.0 m -58.48 -27.95 64.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.117 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.667 HD21 HG21 ' A' ' 28' ' ' ILE . 54.6 tp -72.17 88.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 96' ' ' PRO . 24.3 mmtt -134.96 159.29 41.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 53.3 t -60.75 147.03 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.79 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -62.59 -39.91 95.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.506 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -99.7 -63.12 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.434 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.2 m -56.36 -33.23 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.314 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 53.68 24.98 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.026 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -86.03 161.51 49.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.261 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HA ' ' HD3' ' A' ' 89' ' ' LYS . 51.2 Cg_exo -54.18 118.96 5.58 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.594 2.196 . . . . 0.0 112.309 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 mp -126.83 74.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.809 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -116.64 30.98 7.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -137.43 -55.04 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.451 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.71 135.07 47.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.933 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.839 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.6 t -113.02 163.87 14.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.834 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.9 t80 -165.32 120.95 1.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 90.1 p -151.98 172.35 16.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -167.43 123.99 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.5 -87.1 1.31 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.471 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -150.77 36.25 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.883 0.373 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.7 m -156.23 142.5 18.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.1 p -112.6 115.98 51.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -130.08 121.03 25.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.84 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.0 p -49.63 173.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.224 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 11.7 mtpt -78.16 -28.79 48.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.452 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.4 t70 -52.91 -52.91 56.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.264 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -84.05 -20.7 32.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.277 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.484 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 14.4 t80 -61.48 -33.3 73.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.0 110.758 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.6 m-85 -59.71 -45.34 92.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.77 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -74.68 -27.02 60.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.005 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -64.2 -54.99 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.223 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -117.03 -42.99 2.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -56.93 171.89 2.46 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -58.93 149.22 27.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.789 0.328 . . . . 0.0 110.931 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -150.88 162.13 41.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 16.1 t -79.0 155.8 28.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.953 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -111.09 -20.56 12.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.363 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.485 ' HB2' ' CD2' ' A' ' 143' ' ' TYR . . . -78.22 -58.03 3.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.05 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.26 -12.08 21.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.186 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 36.75 12.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.5 tp -109.49 144.17 38.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.44 104.25 0.74 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.553 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 142' ' ' VAL . 64.8 mt -61.42 140.38 94.75 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.638 0.256 . . . . 0.0 110.987 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.568 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 83.8 Cg_exo -43.97 170.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.874 2.383 . . . . 0.0 112.814 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.35 -55.58 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.479 2.12 . . . . 0.0 114.831 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.857 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.63 21.48 7.07 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 84.2 mm-40 -59.57 -178.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.791 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.604 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -122.52 114.35 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.071 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.564 HG22 ' N ' ' A' ' 136' ' ' ARG . 11.4 p -157.05 164.56 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.564 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -95.8 137.68 34.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.346 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.519 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.61 133.52 49.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.018 -179.267 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.632 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -67.96 96.31 0.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.761 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.427 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 39.97 -89.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.4 t70 -80.64 -39.53 27.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.377 -177.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 138' ' ' ALA . 2.9 m-85 -106.65 173.35 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.852 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.9 p -126.65 149.0 31.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.604 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.632 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.6 m-85 -131.88 158.88 40.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 111.364 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 76.7 m80 -71.53 137.92 48.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.042 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.54 -17.79 60.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.33 -37.37 21.7 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.393 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 7.7 p -96.43 -19.05 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.73 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 4.8 t80 -60.1 119.53 8.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.708 0.29 . . . . 0.0 110.804 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.02 -176.87 1.77 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.207 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.67 150.06 25.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 5.4 m -68.98 -30.16 45.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.143 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -109.48 -52.61 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.173 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 13.8 m -66.04 -28.1 68.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.005 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 58.01 34.58 24.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.995 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -115.47 137.33 52.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.449 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.7 mt-30 -64.63 155.25 33.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.025 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.693 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.1 mm? -115.44 164.25 14.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.682 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.08 169.34 18.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.418 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 m -42.79 122.19 2.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.71 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.24 -22.87 36.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.724 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.443 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.9 t70 -64.35 128.88 37.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 110.774 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 53.6 mt-10 -91.31 115.35 27.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -137.44 169.26 18.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.021 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.531 ' HB2' HG13 ' A' ' 172' ' ' VAL . 87.2 m-85 -115.51 171.01 7.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.628 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.9 OUTLIER -124.93 116.45 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.821 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mtp -72.26 -176.24 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.976 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.01 -26.22 31.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.18 30.33 2.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.049 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 12.9 p 58.32 45.35 17.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.025 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.06 155.3 19.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -105.06 123.47 47.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.531 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.9 p -142.54 125.26 13.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.06 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 23.3 p -78.53 -171.0 2.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.951 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -79.1 -30.18 43.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.149 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.55 -34.94 79.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.389 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -104.14 4.11 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.594 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 8.8 t80 -65.93 -66.12 0.59 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 110.778 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -59.12 -26.06 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.032 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.5 m -72.98 -27.69 61.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.093 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.35 -32.12 12.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.914 0.387 . . . . 0.0 110.738 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' LYS . . . . . 0.446 ' HE3' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER 179.29 171.54 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.929 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.876 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.442 HG22 ' N ' ' A' ' 8' ' ' MET . 12.8 p . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.881 0.372 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.576 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -154.98 -173.12 4.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.627 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.412 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.0 p -155.06 144.8 13.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.223 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 32.6 t -67.79 146.2 13.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.688 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -129.92 -176.18 14.33 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.629 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 3.6 mm-40 -59.85 148.2 76.95 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 120.573 0.225 . . . . 0.0 110.775 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.837 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.6 Cg_exo -77.92 137.02 15.38 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.642 2.228 . . . . 0.0 112.586 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.01 142.85 5.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.985 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.807 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -120.53 173.6 7.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.202 0.525 . . . . 0.0 111.445 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.567 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -71.17 -28.84 64.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.017 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.957 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.72 56.28 26.16 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.304 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.52 -50.17 70.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.6 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 70.08 -64.81 0.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.48 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER 62.85 163.14 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.907 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.46 -170.94 44.1 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.577 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -59.19 -28.47 66.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 0.0 111.078 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -56.64 -29.47 62.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.52 -75.28 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' CG ' ' CE2' ' A' ' 102' ' ' PHE . 52.4 mm-40 -113.57 172.83 6.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.845 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ptp85 -76.04 144.49 40.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.673 HD21 ' HG2' ' A' ' 100' ' ' ARG . 1.5 tp -111.99 163.68 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.819 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 4.6 pt -62.93 161.83 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.176 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -130.81 106.85 8.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.3 101.8 7.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.534 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -142.62 150.36 40.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.431 ' HG3' ' CD1' ' A' ' 74' ' ' PHE . 2.8 mt-10 -68.48 157.06 36.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HG22 ' A' ' 34' ' ' THR . 2.4 m120 -123.7 19.5 9.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.226 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 33' ' ' ASN . 13.6 t 43.95 31.21 0.48 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.382 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -120.24 162.3 19.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -177.14 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -114.04 107.3 15.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.956 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.576 ' HB3' HD22 ' A' ' 71' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.076 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.727 0.299 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.38 161.35 46.23 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.497 2.132 . . . . 0.0 112.246 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 60.2 33.84 21.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.514 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.6 tp -108.94 134.63 20.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.453 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.8 Cg_endo -60.17 125.99 19.0 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.435 2.09 . . . . 0.0 112.119 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.38 140.51 30.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.107 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.0 p -58.07 164.2 2.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.975 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.456 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.46 114.59 23.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.515 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.83 -69.81 0.46 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.6 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.1 p -105.25 153.77 21.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -74.52 87.13 2.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.21 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -179.22 133.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.644 ' CD2' HD23 ' A' ' 71' ' ' LEU . 17.4 p-80 -72.1 143.62 48.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 84' ' ' HIS . 4.9 mm -70.76 152.08 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.644 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.7 OUTLIER -174.21 35.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.91 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -107.53 162.84 13.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.925 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -59.64 -74.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.431 ' CD1' ' HG3' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -82.91 120.87 26.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.021 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.32 146.68 28.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.205 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.7 106.67 17.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.435 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -91.48 127.61 36.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -166.68 165.24 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.188 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.804 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.2 mt 59.25 37.25 23.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.109 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.83 29.52 17.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.014 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -169.89 -179.15 3.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 25.9 p-80 -97.2 124.63 41.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.87 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.804 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.4 m95 -115.77 130.58 56.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.718 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.564 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.99 170.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.909 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 p -80.02 -40.07 28.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.0 mttm -90.57 -26.85 19.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 68.4 m -71.06 -30.27 66.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.971 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.65 HD11 ' SG ' ' A' ' 101' ' ' CYS . 18.4 tp -76.6 80.3 3.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.852 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -135.94 153.18 51.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.71 135.48 48.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.766 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -29.21 68.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.063 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.24 -62.92 1.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.146 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.422 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.9 m -58.28 -34.98 71.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 55.33 23.72 5.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.5 m -85.97 156.37 57.9 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.216 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.55 118.95 5.92 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.497 2.131 . . . . 0.0 112.308 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.506 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.0 mp -104.02 65.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -98.05 30.25 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.111 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.797 ' C ' HD11 ' A' ' 28' ' ' ILE . 2.1 mm-40 -140.26 -51.94 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.673 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -132.25 174.36 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.74 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.2 t -157.01 141.6 16.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.449 ' CE2' ' CG ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -133.98 172.04 13.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -147.61 155.26 41.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -170.28 124.04 0.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.23 -90.62 0.36 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.444 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -153.87 36.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 m -153.21 153.08 32.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.3 p -85.71 116.02 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.04 160.19 20.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -97.98 171.22 8.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.743 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 102' ' ' PHE . 1.5 mttt -78.16 -32.9 50.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.477 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.5 -58.08 7.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.543 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -72.92 -20.83 61.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 4.4 t80 -64.38 -33.55 76.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 110.953 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 4.9 m-85 -79.15 -35.24 42.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.01 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -84.96 -59.05 2.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.284 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -71.54 -47.36 55.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.387 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -98.07 37.03 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.361 . . . . 0.0 111.064 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -149.06 -178.95 24.54 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.36 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.567 HG21 ' SD ' ' A' ' 16' ' ' MET . 72.4 m -60.11 153.53 21.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.794 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -144.44 174.27 11.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.126 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.734 ' HB2' HD11 ' A' ' 129' ' ' ILE . 41.8 t -93.4 130.76 39.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.799 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.456 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.81 29.53 3.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.111 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.687 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . . . -125.12 -53.27 1.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.26 -8.34 14.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.323 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 64.07 64.73 0.73 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.934 0.397 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 127' ' ' LEU . 5.2 tp -134.63 175.77 9.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -99.15 99.15 2.08 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.718 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.734 HD11 ' HB2' ' A' ' 122' ' ' CYS . 1.7 mp -74.45 138.14 74.6 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.424 0.154 . . . . 0.0 110.692 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.631 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 89.6 Cg_exo -44.4 173.2 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.596 2.197 . . . . 0.0 112.59 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.69 -55.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.861 2.374 . . . . 0.0 113.814 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.957 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -120.23 21.72 11.63 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.226 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.631 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.6 OUTLIER -67.95 137.55 55.25 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.584 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.837 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -74.14 108.77 5.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.807 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.3 p -143.08 158.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.773 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.41 134.81 39.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.893 0.378 . . . . 0.0 110.777 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -104.96 112.92 26.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.893 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.453 ' HB1' ' OE1' ' A' ' 139' ' ' GLN . . . -79.82 146.92 32.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.795 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.453 ' OE1' ' HB1' ' A' ' 138' ' ' ALA . 18.0 pm0 42.64 -142.28 0.11 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.334 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -89.74 35.26 0.83 Allowed 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.456 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 33.0 m-85 -151.41 169.0 23.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.914 0.388 . . . . 0.0 111.039 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.7 p -103.57 148.65 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.047 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.687 ' CZ ' ' HB2' ' A' ' 124' ' ' ALA . 6.9 m-85 -126.89 175.06 8.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.967 0.413 . . . . 0.0 111.21 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.458 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.8 m80 -104.95 136.85 43.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.648 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -55.75 -22.4 23.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 177.754 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.33 -36.0 14.1 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.674 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -97.14 1.65 50.18 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.945 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.458 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.5 t80 -86.03 115.84 23.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.777 0.323 . . . . 0.0 110.645 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.0 -176.95 1.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.259 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.54 150.21 20.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.025 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 152' ' ' VAL . 14.2 m -67.44 -27.29 38.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.289 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 151' ' ' VAL . 28.3 t -104.11 -55.7 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.424 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 30.1 m -65.94 -28.04 68.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.981 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm 57.53 28.5 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.999 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 34.2 mtm180 -121.74 147.75 45.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.425 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.7 mt-30 -66.76 153.43 43.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.038 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.702 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.1 mm? -115.89 139.93 49.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.728 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -107.37 167.0 10.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.163 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 t -46.79 138.55 6.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.33 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.33 -32.59 6.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.499 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.412 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.5 m-20 -63.81 128.92 37.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.766 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.404 ' HA ' HG23 ' A' ' 9' ' ' VAL . 11.7 mt-10 -93.7 116.18 28.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.994 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.65 ' CD2' HD23 ' A' ' 171' ' ' LEU . 13.8 p90 -126.91 166.28 17.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.917 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 23.4 m-85 -117.27 171.17 8.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.144 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 168' ' ' ASP . 1.2 tp -124.38 111.02 15.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.429 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 2.8 mmt -60.94 -89.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.264 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -83.23 -49.16 9.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.802 0.334 . . . . 0.0 111.097 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ASP . . . . . 0.496 ' O ' HD21 ' A' ' 165' ' ' LEU . 2.3 t0 176.82 -38.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.748 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 33.7 p -115.4 30.76 7.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.9 mtt180 -120.48 132.21 55.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.65 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -103.84 123.69 47.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.837 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.512 HG13 ' O ' ' A' ' 172' ' ' VAL . 13.4 p -145.07 118.92 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.094 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.3 m -55.37 -176.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.015 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -69.31 -49.0 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.17 84.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -59.45 -25.95 64.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.937 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -54.54 -65.31 0.6 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.018 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -54.13 -23.49 14.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.304 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.0 m -87.07 -26.77 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -52.07 4.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.487 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 171.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.927 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 -179.959 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 11.0 p . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.845 0.355 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -146.1 -179.3 6.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.679 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.4 p -155.02 135.38 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.29 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' CD1' ' A' ' 163' ' ' PHE . 41.3 t -59.03 146.27 9.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.489 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -136.12 -159.75 8.57 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.743 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.33 123.27 69.35 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.514 0.197 . . . . 0.0 110.901 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.566 ' HB2' HG12 ' A' ' 134' ' ' VAL . 23.1 Cg_exo -62.03 138.42 72.96 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.309 2.006 . . . . 0.0 112.263 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -166.03 148.56 7.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.781 HD11 HG22 ' A' ' 129' ' ' ILE . 1.1 mt -116.84 173.4 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.294 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.437 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.58 -37.09 77.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.866 179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.9 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.44 81.54 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.543 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.84 -72.29 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 60.67 86.87 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.782 0.325 . . . . 0.0 110.826 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.524 ' CZ ' ' CE1' ' A' ' 115' ' ' PHE . 29.7 p90 -59.79 -44.47 93.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.036 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.436 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 57.39 -120.91 23.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.563 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -83.94 -23.86 30.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.733 0.301 . . . . 0.0 111.168 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.99 -29.98 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.175 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.19 -73.55 0.39 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.874 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 19.9 tp10 -120.99 163.49 18.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 147.87 38.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.3 mm? -101.58 165.13 11.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.972 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.875 HG21 HD21 ' A' ' 88' ' ' LEU . 4.1 pt -62.97 144.01 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.147 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.6 m -110.29 106.85 16.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 101.83 10.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.552 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.512 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.35 157.16 44.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.996 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -87.04 157.05 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -110.83 -178.09 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 p -120.64 37.22 4.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -90.42 -54.03 4.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.0 t80 68.5 -68.1 0.18 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.9 -65.26 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.211 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.767 0.318 . . . . 0.0 110.888 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -51.72 164.7 0.91 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.554 2.169 . . . . 0.0 112.293 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 59.31 31.2 20.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.445 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -109.79 135.0 20.46 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.445 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.56 125.95 18.66 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.379 2.053 . . . . 0.0 112.144 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.54 139.34 30.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.9 p -57.73 164.22 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.3 114.67 23.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.44 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.45 -75.04 0.38 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.607 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.2 p -98.78 152.33 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 110.941 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 87.25 1.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.02 136.85 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.4 p-80 -73.76 151.48 40.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.972 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.541 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -79.69 153.51 4.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.908 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.521 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.41 35.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -109.3 163.05 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -77.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.42 120.57 22.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.9 mm -122.83 154.02 27.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.6 mp -112.2 106.83 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.369 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -90.85 129.39 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.967 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -161.41 162.78 30.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.182 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.658 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 55.01 36.13 26.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.14 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 62.5 30.19 17.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.012 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -164.03 170.11 17.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 30.8 p-80 -88.38 120.94 30.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.682 ' CB ' HD13 ' A' ' 88' ' ' LEU . 47.4 m95 -110.17 130.04 55.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.541 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.54 174.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.7 t -79.99 -42.17 24.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -90.35 -29.75 17.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.956 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.6 m -69.63 -31.41 69.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.875 HD21 HG21 ' A' ' 28' ' ' ILE . 7.3 tp -72.82 77.52 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -137.05 165.46 25.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.809 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.59 147.07 39.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -28.49 67.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.013 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -111.49 -57.24 2.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 26.9 m -57.76 -46.1 85.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.067 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 94' ' ' HIS . 10.5 t-160 58.31 21.7 8.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.538 ' O ' HD13 ' A' ' 97' ' ' LEU . 13.3 m -86.47 155.69 56.74 Favored Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.118 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 118.98 5.95 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.495 2.13 . . . . 0.0 112.081 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 88' ' ' LEU . 7.4 mp -107.59 64.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.805 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -100.04 30.66 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.112 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.78 ' N ' HD11 ' A' ' 28' ' ' ILE . 15.3 mm-40 -138.48 -47.23 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.676 ' CB ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -153.58 148.12 26.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.816 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.634 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.5 t -143.2 128.24 18.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.438 ' CD1' ' HG3' ' A' ' 111' ' ' LYS . 0.6 OUTLIER -111.52 172.03 7.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.807 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 p -152.24 122.72 7.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.946 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.13 124.06 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.13 -102.02 2.01 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.495 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -143.56 34.92 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -153.33 152.46 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.436 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.9 p -77.98 124.47 36.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -121.01 143.31 49.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.002 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.0 p -87.91 153.54 21.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.438 ' HG3' ' CD1' ' A' ' 102' ' ' PHE . 29.6 mtpt -56.21 -34.69 66.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.927 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.403 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 5.5 t0 -63.43 -28.05 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -83.91 -22.95 31.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.202 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.516 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 8.8 t80 -73.86 -49.81 23.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.029 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.524 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 m-85 -51.88 -40.23 60.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.853 0.359 . . . . 0.0 111.239 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -85.07 -64.11 1.21 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.465 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -59.91 -49.27 78.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.58 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -109.26 37.02 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -164.39 168.1 38.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.6 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' HG11 ' A' ' 142' ' ' VAL . 85.8 m -61.55 154.99 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.69 0.281 . . . . 0.0 110.659 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -162.11 161.15 28.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 111.168 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.02 137.27 56.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.84 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.6 29.76 3.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -58.18 1.47 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.292 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 17.1 p -110.85 8.15 22.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.46 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 59.51 29.44 19.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.697 0.284 . . . . 0.0 111.069 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 tp -92.18 121.69 33.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.48 112.08 3.42 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.763 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.781 HG22 HD11 ' A' ' 15' ' ' LEU . 4.2 mt -71.77 132.92 84.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 76.1 Cg_exo -47.37 176.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.297 1.998 . . . . 0.0 112.592 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.03 -52.13 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.113 2.542 . . . . 0.0 113.632 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.9 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.03 22.02 7.39 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.092 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -55.88 -169.94 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.678 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.806 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -120.14 108.81 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.019 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.779 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.1 p -157.05 160.93 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.942 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.61 134.87 39.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.487 179.743 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.401 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -112.14 135.87 52.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.878 -179.642 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.829 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -71.21 96.67 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.977 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.65 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.359 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 138' ' ' ALA . 3.2 t70 -90.55 -46.07 8.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.782 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.644 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.462 HG11 ' CG2' ' A' ' 120' ' ' THR . 10.5 p -117.1 150.61 19.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.679 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.484 ' O ' HG21 ' A' ' 135' ' ' VAL . 27.5 m-85 -132.16 174.95 9.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.443 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -79.43 165.24 23.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.913 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.806 HD21 ' O ' ' A' ' 134' ' ' VAL . 3.3 mp -81.07 -32.32 34.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -91.36 -49.29 6.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.727 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.443 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 69.3 m -53.55 -29.6 37.71 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.127 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.788 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.89 114.68 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.086 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.529 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.19 154.24 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.035 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.56 149.96 28.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 152' ' ' VAL . 5.1 m -63.9 -28.22 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.402 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 151' ' ' VAL . 19.7 t -109.07 -56.7 4.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.338 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 31.7 m -65.92 -28.13 68.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.172 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.529 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 68.5 mttt 49.93 48.57 21.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.072 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -118.35 136.66 53.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.026 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.2 149.51 19.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.319 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.712 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.6 OUTLIER -114.9 162.26 17.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.499 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 172.56 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 3.5 m -45.43 125.34 5.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.398 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.87 -22.76 37.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.694 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.461 ' C ' HG23 ' A' ' 9' ' ' VAL . 10.1 t70 -62.19 128.9 38.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 110.765 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 9' ' ' VAL . 56.5 mt-10 -87.98 123.42 32.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.94 0.4 . . . . 0.0 111.098 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.891 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -144.0 156.4 44.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.705 ' HB2' HG13 ' A' ' 172' ' ' VAL . 47.4 m-85 -108.62 171.1 7.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.829 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -125.31 121.34 33.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.853 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 6.7 mmt -81.6 166.97 19.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -65.86 -28.43 68.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -97.68 29.23 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.2 57.04 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.468 ' HB3' HG11 ' A' ' 151' ' ' VAL . 4.6 mtt180 -125.66 128.29 47.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' A' ' 163' ' ' PHE . 3.0 mp -78.6 133.29 37.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.705 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.5 p -145.06 137.27 21.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.935 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.6 p -81.56 169.13 17.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -59.13 -51.79 68.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.6 -25.47 52.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.293 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -96.81 -14.54 21.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.381 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.401 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 7.2 t80 -57.58 -66.0 0.54 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.371 . . . . 0.0 110.911 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.36 -28.49 70.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.139 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.9 m -75.33 -33.3 61.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.062 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -88.9 -49.58 6.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.216 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm 62.34 175.36 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.927 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.933 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 8' ' ' MET . 13.2 p . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.852 0.358 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.498 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -157.21 -170.61 3.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.667 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.5 p -155.04 147.59 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 157' ' ' LEU . 22.5 t -61.85 146.31 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.652 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.4 -163.54 10.49 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.521 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.69 130.04 84.26 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.449 0.166 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.892 ' HB2' HG12 ' A' ' 134' ' ' VAL . 25.2 Cg_exo -60.67 146.91 96.37 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.269 1.979 . . . . 0.0 112.399 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.13 160.56 24.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.465 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -144.02 173.58 11.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.066 0.46 . . . . 0.0 111.36 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -39.85 94.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.896 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.39 83.02 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.642 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.34 -126.01 3.24 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.32 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 170.51 -33.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 110.826 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 3.4 t80 69.18 161.67 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.869 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -111.02 127.14 8.1 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.627 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.575 ' OD1' HD11 ' A' ' 27' ' ' LEU . 9.5 t0 -84.05 -30.42 26.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.875 0.369 . . . . 0.0 110.936 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -58.07 -24.51 58.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.114 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.66 -30.13 54.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.06 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.446 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.9 OUTLIER -109.14 175.99 5.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.908 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.7 mmt85 -94.38 99.97 12.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.4 mm? -69.96 161.34 30.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.864 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.783 HG23 ' HB2' ' A' ' 101' ' ' CYS . 6.2 pt -62.99 138.52 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 m -100.52 106.84 18.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.2 mtm-85 -84.69 101.73 12.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.377 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -133.74 151.43 51.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.88 96.97 3.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.408 ' OD1' HD13 ' A' ' 31' ' ' LEU . 1.8 m120 -68.34 116.15 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -65.59 79.22 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -151.8 78.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -96.02 -31.49 13.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -127.42 115.66 19.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.125 179.939 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.688 0.28 . . . . 0.0 110.851 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.37 164.07 35.56 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.562 2.175 . . . . 0.0 112.209 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 59.08 31.61 21.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.857 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.4 tp -106.56 134.7 19.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.112 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.438 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.9 Cg_endo -61.17 125.99 18.33 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.388 2.059 . . . . 0.0 112.084 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.9 139.81 30.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.069 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.7 p -57.54 164.14 2.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.958 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.42 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.31 114.61 23.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.481 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.06 -71.36 0.44 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.601 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.8 p -103.56 152.94 21.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.774 0.321 . . . . 0.0 110.981 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.45 87.2 2.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.11 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -178.79 135.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.704 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.0 p-80 -71.39 143.47 50.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 70' ' ' ILE . 3.4 mm -68.76 147.62 12.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.704 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.7 35.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.929 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' HD11 ' A' ' 75' ' ' ILE . 2.0 m-20 -111.39 144.6 40.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.91 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -34.26 67.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.109 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.585 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.0 m-85 -106.19 112.03 24.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.585 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.6 mm -132.61 147.48 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -109.82 107.35 17.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.286 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -90.77 122.5 33.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.055 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.778 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -164.71 167.1 19.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.8 mt 62.95 37.04 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 29.18 17.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.065 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -170.62 -179.56 2.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.1 p80 -97.99 124.45 42.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.776 ' CB ' HD13 ' A' ' 88' ' ' LEU . 42.2 m95 -116.54 130.8 56.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.779 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.71 172.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p -79.57 -40.62 29.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -91.0 -28.47 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.54 -31.15 68.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.993 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.776 HD13 ' CB ' ' A' ' 83' ' ' TRP . 5.2 tp -80.86 94.38 6.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.976 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -144.07 156.77 44.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 23.7 t -60.0 147.13 40.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.805 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.3 m -74.21 -28.88 61.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.173 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -101.39 -63.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.135 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.468 ' HB2' HG22 ' A' ' 95' ' ' VAL . 37.2 m -60.07 -30.69 69.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.097 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 57.31 23.18 8.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.468 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.0 m -85.81 156.31 58.38 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.247 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.57 118.93 5.96 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.525 2.15 . . . . 0.0 112.297 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -103.8 86.69 2.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -114.84 30.5 7.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.092 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.7 ' C ' HD11 ' A' ' 28' ' ' ILE . 41.2 mt-10 -140.03 -47.37 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.619 ' CB ' HD12 ' A' ' 27' ' ' LEU . 1.9 mpp_? -150.81 146.46 26.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.811 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.783 ' HB2' HG23 ' A' ' 28' ' ' ILE . 14.5 t -126.13 158.92 34.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.446 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.62 119.98 5.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 79' ' ' LEU . 17.8 p -139.11 150.86 46.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.24 124.0 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.828 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -114.4 4.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.535 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -123.87 32.99 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 0.0 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.2 m -157.69 166.89 31.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.5 p -129.33 115.98 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.077 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.2 OUTLIER -131.7 132.42 43.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -52.06 167.02 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 115' ' ' PHE . 1.7 mtmt -67.19 -30.43 70.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 4.8 t70 -55.2 -48.86 73.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -72.23 -20.9 61.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.051 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 118' ' ' PHE . 10.4 t80 -66.4 -41.05 89.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.951 0.405 . . . . 0.0 110.809 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.4 m-85 -67.77 -26.16 65.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.944 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -43.81 25.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.21 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 118' ' ' PHE . 14.4 ptp180 -79.27 -47.24 16.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.382 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 114' ' ' PHE . 76.3 m-85 -84.52 -43.02 14.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.99 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.94 167.89 40.57 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.574 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.8 m -59.58 152.93 20.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.6 172.24 14.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.069 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.2 t -63.77 138.57 58.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.71 29.53 2.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.995 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.22 -58.13 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.963 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 16.3 p -108.24 12.66 26.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.289 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 54.12 30.0 11.33 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.87 0.367 . . . . 0.0 111.083 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 144' ' ' HIS . 18.6 tp -94.1 138.65 31.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.909 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -65.4 130.79 34.98 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.688 HG22 HD11 ' A' ' 15' ' ' LEU . 22.3 mt -87.0 126.82 61.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.435 0.159 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.636 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 86.0 Cg_exo -44.43 173.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.72 2.28 . . . . 0.0 112.706 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.87 -55.12 0.22 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.866 2.377 . . . . 0.0 113.684 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.896 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.2 21.42 7.36 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.296 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.636 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.0 OUTLIER -59.02 138.54 57.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.388 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.892 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.0 OUTLIER -78.14 108.64 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.988 0.423 . . . . 0.0 110.891 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.754 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.9 p -143.12 161.04 17.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.951 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.664 ' HD3' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -96.78 134.98 39.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.929 0.395 . . . . 0.0 110.822 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.19 157.89 16.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.956 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.759 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -100.6 96.75 7.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.756 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.475 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.38 -86.52 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.497 0.665 . . . . 0.0 111.821 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -100.22 -48.97 4.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.783 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -82.59 161.78 22.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.628 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.471 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.6 p -106.31 151.28 8.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.672 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.521 ' O ' HG21 ' A' ' 135' ' ' VAL . 19.5 m-85 -129.68 174.97 9.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.036 0.446 . . . . 0.0 111.394 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -78.0 160.73 27.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.773 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.664 HD12 ' HD3' ' A' ' 136' ' ' ARG . 16.3 tp -81.03 -31.3 34.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.857 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -91.27 -49.28 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.913 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.3 m -53.35 -30.14 37.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.231 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.725 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 1.3 t80 -56.84 116.16 3.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.099 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.16 -177.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.926 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.0 t -99.88 150.04 22.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.62 HG11 ' HG2' ' A' ' 170' ' ' ARG . 6.0 m -65.91 -26.37 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.314 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.616 HG23 HG23 ' A' ' 151' ' ' VAL . 25.7 t -107.89 -55.76 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.371 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.01 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 53.9 34.98 20.65 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.159 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -124.68 143.93 50.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.435 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.3 mt-30 -59.01 154.06 16.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.6 mm? -111.77 123.05 49.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -99.25 158.18 15.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.7 t -44.84 132.48 6.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.534 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 106.81 -32.38 7.32 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.548 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.513 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -71.02 133.61 46.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.834 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -87.97 116.12 25.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.027 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.814 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -126.5 144.65 50.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 5.0 m-85 -96.97 147.39 24.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.759 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -106.53 110.94 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.6 mmt -72.52 150.01 43.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -59.36 -28.76 67.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.012 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -97.48 36.2 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.996 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 3.1 p 49.97 83.6 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.184 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.62 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.7 OUTLIER -156.43 120.38 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.814 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -80.12 126.5 31.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.09 127.87 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 52.6 m -58.34 -173.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HE3' ' CE2' ' A' ' 164' ' ' TYR . 0.1 OUTLIER -72.8 -49.59 29.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -68.2 -44.12 76.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.119 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -58.81 -23.61 60.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.37 -65.97 0.5 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.46 -27.89 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.14 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.3 m -78.56 -30.44 46.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.065 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.88 16.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.257 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm 61.32 175.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.797 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.92 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.456 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.895 0.378 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.504 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -158.08 -175.87 5.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.527 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.463 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.0 p -155.03 131.82 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.185 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.473 HG23 ' CD1' ' A' ' 163' ' ' PHE . 57.8 t -55.71 146.3 5.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.667 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.501 ' C ' HG23 ' A' ' 159' ' ' THR . . . -127.5 -161.42 10.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.513 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -61.68 139.46 95.3 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.512 0.196 . . . . 0.0 110.759 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.3 Cg_exo -77.69 132.66 12.2 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.572 2.181 . . . . 0.0 112.193 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.02 155.74 25.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.2 mt -131.6 173.53 11.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.175 0.512 . . . . 0.0 111.525 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.527 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.6 -32.14 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.745 179.721 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.958 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.59 58.57 13.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.531 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -91.49 -75.34 1.3 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.563 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 65.56 77.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.478 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.8 OUTLIER -57.89 -170.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.65 -163.28 34.46 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.541 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -84.0 -31.84 25.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.753 0.311 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -59.58 -26.75 65.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.051 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.23 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.03 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 13.0 mm-40 -103.28 175.25 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.966 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -84.15 134.32 34.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.857 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 100' ' ' ARG . 3.0 mm? -95.43 165.01 12.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.969 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.691 HG23 ' HB2' ' A' ' 101' ' ' CYS . 9.4 pt -62.91 134.91 27.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.166 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -95.16 106.89 18.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.967 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.21 101.76 6.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.414 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.07 154.19 43.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -79.01 156.99 28.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -115.25 116.62 28.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.537 HG23 ' O ' ' A' ' 34' ' ' THR . 6.5 t -75.19 89.52 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.891 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 34' ' ' THR . 4.2 mp0 -149.07 -73.43 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 68.13 -69.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.994 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.28 107.65 5.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.69 ' O ' HD22 ' A' ' 71' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.07 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.647 0.26 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.27 165.14 27.79 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.489 2.126 . . . . 0.0 112.146 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 58.66 30.03 19.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.794 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.508 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -103.57 135.33 19.39 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.431 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.1 Cg_endo -60.92 125.96 18.43 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.35 2.034 . . . . 0.0 112.062 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.99 163.55 22.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.088 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.3 t -73.82 154.71 39.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.575 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.55 114.65 21.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.498 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.65 -50.03 0.81 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.453 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.5 p -108.64 -179.0 3.74 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.847 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -108.0 75.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.012 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.25 132.5 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.508 ' CD2' HG21 ' A' ' 60' ' ' ILE . 9.3 p80 -63.85 134.84 55.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.491 ' HA ' HD13 ' A' ' 70' ' ' ILE . 4.7 mm -59.65 151.54 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.937 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.69 HD22 ' O ' ' A' ' 38' ' ' ALA . 0.6 OUTLIER -174.58 36.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.873 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -107.16 158.23 17.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -60.13 -74.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.6 121.15 24.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.995 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.2 mm -124.86 151.49 30.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.205 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 mp -109.74 106.98 16.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.392 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -90.75 124.38 35.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -159.04 159.9 35.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.13 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.834 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.9 OUTLIER 58.31 36.44 25.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.44 32.7 16.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.04 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 mtm-85 -170.02 169.93 7.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -86.42 127.41 34.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.623 ' CB ' HD13 ' A' ' 88' ' ' LEU . 53.5 m95 -119.81 123.71 44.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.8 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.78 172.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.992 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -77.11 -47.8 19.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.855 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -85.91 -25.81 25.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 84.5 m -73.82 -28.2 61.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.775 HD23 ' O ' ' A' ' 97' ' ' LEU . 15.9 tp -80.79 90.17 5.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.002 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -143.71 154.83 43.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 8.4 t -59.85 147.06 39.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.847 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.4 m -73.51 -28.78 62.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.154 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -101.43 -63.05 1.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.189 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.525 ' HB2' HG22 ' A' ' 95' ' ' VAL . 30.0 m -59.83 -29.8 68.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.66 22.72 8.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.015 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.525 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.2 m -84.81 156.47 61.2 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.138 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.98 5.92 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.534 2.156 . . . . 0.0 112.366 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.775 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.1 mp -104.88 61.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.828 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.32 40.51 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.575 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.9 mm-40 -151.7 -46.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.693 ' HB3' HD12 ' A' ' 27' ' ' LEU . 40.6 mtm180 -148.23 143.61 27.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.834 ' SG ' HD21 ' A' ' 79' ' ' LEU . 51.3 t -119.16 156.05 30.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.99 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.444 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.82 119.97 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.775 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.408 ' HB2' HD22 ' A' ' 79' ' ' LEU . 1.2 t -96.73 160.53 14.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.448 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 0.0 OUTLIER -164.67 123.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.52 -131.86 51.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -98.85 31.62 2.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.885 0.374 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.3 m -162.66 173.73 13.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.797 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.546 HG13 ' O ' ' A' ' 108' ' ' VAL . 13.8 p -102.15 115.86 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.35 120.94 36.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.857 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.1 p -60.33 172.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.13 -32.19 50.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.773 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.443 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -51.74 -57.99 7.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.424 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -74.15 -20.67 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.478 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 t80 -62.19 -26.36 68.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.94 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.443 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 3.7 m-85 -78.97 -39.61 33.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.036 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -85.04 -51.03 6.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.253 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 -73.35 -51.35 17.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.448 ' CE2' ' CD ' ' A' ' 104' ' ' ARG . 5.1 m-85 -102.79 37.04 2.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.108 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.65 162.96 32.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.449 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.48 ' CG2' HG11 ' A' ' 142' ' ' VAL . 74.8 m -58.76 152.16 19.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.761 0.315 . . . . 0.0 110.959 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 126' ' ' GLN . 0.1 OUTLIER -169.01 147.88 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.449 ' N ' HD11 ' A' ' 129' ' ' ILE . 38.0 t -65.44 130.84 44.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.922 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -95.67 23.45 6.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -41.61 2.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.978 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.9 m -106.94 -12.9 15.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.293 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER 63.95 30.27 14.23 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 0.0 110.784 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.411 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.9 tp -106.61 137.65 44.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.61 102.28 0.8 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.646 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.485 ' CD1' HG13 ' A' ' 142' ' ' VAL . 6.7 mt -60.26 140.38 91.39 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.493 0.187 . . . . 0.0 110.801 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.626 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 84.1 Cg_exo -47.34 173.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.468 2.112 . . . . 0.0 112.31 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.39 -54.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.47 2.113 . . . . 0.0 113.85 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.958 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -121.88 21.59 10.63 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.0 OUTLIER -59.02 140.01 56.21 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.512 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.732 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -80.12 108.74 13.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.934 0.397 . . . . 0.0 110.727 -179.862 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.2 p -154.64 158.91 3.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.218 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -96.91 137.98 35.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.653 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.85 131.09 54.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.768 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.583 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -59.76 96.53 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.662 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.506 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.5 OUTLIER 54.03 -86.47 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.391 0.615 . . . . 0.0 111.61 -179.69 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.9 m-20 -99.42 -48.47 4.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -80.63 166.59 20.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.585 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.485 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.7 p -127.15 157.24 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.647 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.583 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 22.7 m-85 -153.58 161.79 41.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.4 . . . . 0.0 111.324 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 77.0 m80 -60.62 145.4 49.15 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.308 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.511 ' CD2' HG23 ' A' ' 135' ' ' VAL . 0.3 OUTLIER -66.76 -17.95 65.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -81.94 -49.02 10.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.946 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 15.1 p -81.06 -29.87 34.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.172 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.672 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 20.0 t80 -63.08 99.07 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.84 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' A' ' 155' ' ' ARG . . . -162.0 175.28 11.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.098 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 47.1 t -78.72 150.21 32.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.723 HG11 ' NH1' ' A' ' 170' ' ' ARG . 34.5 m -72.26 -39.82 64.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.419 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.704 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -83.45 -57.23 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.549 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 35.2 m -65.89 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.9 34.36 23.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' ARG . . . . . 0.553 ' O ' ' HB1' ' A' ' 149' ' ' ALA . 54.0 mtm-85 -128.98 151.41 49.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -75.71 150.42 37.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.948 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.694 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.2 mm? -100.88 171.49 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.811 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.03 167.18 23.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.938 0.399 . . . . 0.0 111.275 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.501 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.2 m -43.27 129.14 4.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.644 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.19 -22.94 33.95 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.828 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.463 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.8 t0 -67.94 129.03 38.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.86 0.362 . . . . 0.0 110.81 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.427 ' HA ' HG23 ' A' ' 9' ' ' VAL . 32.2 mt-10 -88.02 123.64 32.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.033 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.58 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.3 p90 -141.45 162.39 35.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.072 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.539 ' HB2' HG13 ' A' ' 172' ' ' VAL . 50.9 m-85 -110.93 171.03 7.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.908 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.506 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.1 tp -131.77 110.97 11.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.9 mmt -73.53 -89.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.137 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -83.2 -49.2 9.69 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.84 0.352 . . . . 0.0 110.963 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -173.91 -59.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.675 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.411 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . 32.8 t -93.3 -22.99 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.723 ' NH1' HG11 ' A' ' 151' ' ' VAL . 2.9 mmm180 -56.41 102.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.13 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.672 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -91.51 125.77 36.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.826 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.656 HG23 ' OD2' ' A' ' 176' ' ' ASP . 11.8 p -145.03 123.36 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.066 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 5.1 m -66.76 -172.44 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.056 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.423 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 1.4 mtpm? -86.08 -35.99 19.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.776 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.59 67.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.091 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.704 ' HB2' HG21 ' A' ' 152' ' ' VAL . 3.8 p-10 -85.07 4.09 35.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.457 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 21.7 t80 -62.01 -65.98 0.61 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.059 0.457 . . . . 0.0 110.978 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -47.02 -28.63 1.74 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.492 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -30.57 57.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.975 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.06 -20.78 17.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.526 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.46 -178.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.816 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.618 HG11 ' HE2' ' A' ' 174' ' ' LYS . 14.6 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.844 0.354 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -109.27 -165.37 1.01 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.363 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.536 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.4 p -155.06 144.7 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 0.0 111.369 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.445 HG13 ' HG3' ' A' ' 136' ' ' ARG . 47.8 t -62.06 146.1 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.169 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.68 -159.37 10.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.949 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -68.2 132.83 91.64 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.481 0.181 . . . . 0.0 110.9 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -65.25 145.15 83.25 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.343 2.029 . . . . 0.0 112.567 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.06 142.97 5.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.226 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -124.22 173.67 8.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.942 0.401 . . . . 0.0 111.28 -179.544 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.732 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -72.04 -39.17 69.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.132 -179.823 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 53.04 82.32 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.6 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.31 -51.31 0.25 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.532 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 62.45 -176.09 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 0.0 110.8 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.487 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -156.42 -75.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.64 144.73 14.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.596 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.512 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.8 p-10 -82.41 -30.97 29.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.02 -25.9 63.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.223 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -55.99 -68.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.131 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HG2' ' CE1' ' A' ' 102' ' ' PHE . 3.1 tp10 -75.64 173.45 11.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.02 100.0 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.852 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.696 HD11 ' CB ' ' A' ' 100' ' ' ARG . 2.5 tp -77.22 159.0 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.038 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.4 pt -62.95 127.58 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 m -88.11 106.84 18.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.799 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.08 101.83 11.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -146.09 153.37 40.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.991 -179.747 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -82.2 157.0 24.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -111.39 113.85 26.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.925 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.567 HG23 ' O ' ' A' ' 34' ' ' THR . 7.8 t -70.68 84.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -137.31 -74.77 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.955 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.97 -70.08 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.39 105.61 17.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.923 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.081 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.597 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.663 0.268 . . . . 0.0 110.897 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HD2' HG22 ' A' ' 57' ' ' THR . 60.8 Cg_endo -72.78 164.51 35.37 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.443 2.095 . . . . 0.0 112.262 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 57.09 28.51 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.554 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.4 tp -96.83 135.03 22.35 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.451 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.0 Cg_endo -58.55 125.94 19.86 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.431 2.087 . . . . 0.0 111.994 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 136.14 33.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -58.24 164.17 2.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.904 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.649 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -89.48 114.63 26.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.37 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 128.05 -68.37 0.54 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.538 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 11.7 p -108.43 141.98 39.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.51 83.91 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.015 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 179.57 126.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.554 ' ND1' HG21 ' A' ' 60' ' ' ILE . 26.1 p-80 -63.9 168.2 5.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.909 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.882 HD11 ' NE2' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -106.32 160.13 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.097 0.475 . . . . 0.0 110.818 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.21 35.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.292 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -99.24 -178.61 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.847 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -72.76 0.22 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.419 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -83.67 144.14 29.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.419 HD13 ' O ' ' A' ' 74' ' ' PHE . 37.0 mm -145.44 146.91 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.993 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -108.63 106.81 17.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.412 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -91.05 134.73 34.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -167.6 164.28 14.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.798 HD12 ' CE2' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 58.88 37.46 24.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.08 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.61 28.79 17.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -166.03 176.14 7.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.882 ' NE2' HD11 ' A' ' 70' ' ' ILE . 21.8 p-80 -94.09 128.8 40.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.798 ' CE2' HD12 ' A' ' 79' ' ' LEU . 42.2 m95 -119.64 133.2 55.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.725 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 171.72 0.27 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 t -80.05 -39.76 29.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.3 pttt -90.95 -29.08 17.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.13 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -67.65 -30.76 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.953 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.591 HD21 HG21 ' A' ' 28' ' ' ILE . 5.4 tp -68.43 75.8 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -120.73 136.82 54.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.841 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.26 135.3 57.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.4 m -80.1 -0.89 37.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.681 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 6.3 t0 -107.78 -63.02 1.36 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.716 0.293 . . . . 0.0 111.356 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.483 ' SG ' HG23 ' A' ' 95' ' ' VAL . 30.2 p -94.14 -21.09 19.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.456 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 59.11 39.76 22.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.9 0.381 . . . . 0.0 110.853 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.483 HG23 ' SG ' ' A' ' 93' ' ' CYS . 22.0 t -107.84 129.71 23.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.1 118.89 3.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.568 2.179 . . . . 0.0 112.479 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.677 HD23 ' O ' ' A' ' 100' ' ' ARG . 8.5 mp -85.18 -75.39 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.75 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 57.38 31.82 20.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.238 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.453 ' N ' HD11 ' A' ' 28' ' ' ILE . 6.4 mm-40 -156.45 -75.91 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.924 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.696 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -119.4 130.44 55.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.957 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.731 ' HB2' HG23 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -121.95 128.0 51.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.931 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.416 ' CE1' ' HG2' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -114.72 155.82 25.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.851 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.9 t -133.21 136.19 45.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.987 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -153.91 123.95 6.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.72 -60.58 4.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -176.54 -43.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 0.0 110.937 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 12.9 m -73.35 -170.77 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.0 p -113.03 122.91 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.06 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 92' ' ' ASP . 2.0 m-85 -119.26 155.79 31.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -102.39 149.24 24.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.706 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 2.5 mtmp? -54.57 -40.04 68.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.194 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -59.12 -29.53 67.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.923 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -84.12 -29.75 26.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.487 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 14.3 t80 -64.94 -30.22 71.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 3.5 m-85 -77.21 -41.22 42.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -81.35 -28.01 34.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 38.3 mmt180 -96.04 -55.47 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.22 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.451 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 12.4 m-85 -104.08 29.66 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.195 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.73 -151.14 5.7 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.278 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.732 HG21 ' SD ' ' A' ' 16' ' ' MET . 1.7 m -103.01 153.49 20.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.8 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -144.85 -164.99 2.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.958 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 32.4 t -116.5 139.05 50.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.958 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -104.96 24.97 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.28 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.434 ' HB2' ' CD1' ' A' ' 143' ' ' TYR . . . -125.13 -53.13 1.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.976 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.21 -16.57 13.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.247 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLN . . . . . 0.8 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.2 tt0 71.14 79.45 0.17 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.831 0.348 . . . . 0.0 111.01 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.8 HD12 ' O ' ' A' ' 126' ' ' GLN . 0.4 OUTLIER -156.72 133.82 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.646 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.34 99.83 0.11 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.726 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.612 HG23 ' HD2' ' A' ' 130' ' ' PRO . 59.0 mt -62.49 141.54 96.62 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.548 0.214 . . . . 0.0 110.769 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HD2' HG23 ' A' ' 129' ' ' ILE . 78.6 Cg_exo -42.83 168.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.736 2.291 . . . . 0.0 112.772 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -77.14 -55.64 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.926 2.417 . . . . 0.0 114.737 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.478 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 2.0 m -126.43 21.96 7.13 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -177.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 71.2 mm-40 -58.17 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.322 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.799 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -129.13 108.61 17.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.738 0.304 . . . . 0.0 111.112 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.4 p -143.49 157.68 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.74 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.476 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.48 134.96 39.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.064 0.459 . . . . 0.0 111.252 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.0 172.97 6.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.528 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -146.31 168.97 19.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.229 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.683 ' HG3' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 40.73 -83.82 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.55 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' A' ' 138' ' ' ALA . 21.7 t0 -162.09 38.12 0.12 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.732 0.301 . . . . 0.0 111.19 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.404 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . 0.6 OUTLIER -153.43 157.17 39.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.698 179.717 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.606 HG13 HD12 ' A' ' 129' ' ' ILE . 11.6 p -109.67 153.18 11.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.668 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.655 ' OH ' HD11 ' A' ' 165' ' ' LEU . 14.6 m-85 -143.47 147.54 34.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.023 0.44 . . . . 0.0 111.35 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 77.8 m80 -57.84 143.68 41.52 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.37 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.799 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -65.05 -17.93 64.87 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 176.761 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -82.53 -41.06 20.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.222 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.41 -25.79 20.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.636 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.542 ' CE1' HD21 ' A' ' 171' ' ' LEU . 2.1 t80 -60.54 91.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.84 0.352 . . . . 0.0 110.657 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.548 ' HB1' ' C ' ' A' ' 155' ' ' ARG . . . -167.78 174.25 7.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 49.5 t -76.23 150.25 37.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.612 HG11 ' CG ' ' A' ' 170' ' ' ARG . 6.4 m -74.89 -35.56 36.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.345 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.51 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -88.75 -57.55 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.412 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.8 m -65.86 -28.09 68.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.157 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt 60.31 38.72 19.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' ARG . . . . . 0.548 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 22.4 ttm-85 -128.96 145.14 51.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.028 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -78.29 155.94 29.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.028 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.705 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -106.46 168.72 8.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.675 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.04 166.94 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.315 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.5 m -43.37 122.04 2.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.539 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.73 -23.94 31.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.614 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.536 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.9 t0 -77.29 129.0 35.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.848 0.356 . . . . 0.0 110.88 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 33.3 mt-10 -87.98 121.65 30.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.941 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.651 ' CD2' HD23 ' A' ' 171' ' ' LEU . 17.8 p90 -131.07 179.04 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CZ ' ' HB ' ' A' ' 7' ' ' VAL . 0.7 OUTLIER -132.63 114.91 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.525 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.683 HD22 ' HG3' ' A' ' 139' ' ' GLN . 7.7 tt -93.73 110.81 22.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 0.0 110.51 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.19 159.95 33.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.76 -25.57 7.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.89 27.61 3.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.188 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 5.0 m 55.45 31.19 16.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.024 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.612 ' CG ' HG11 ' A' ' 151' ' ' VAL . 14.9 ttm180 -94.72 102.84 14.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -66.97 126.77 30.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.898 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.647 HG23 ' OD2' ' A' ' 176' ' ' ASP . 8.6 p -145.34 140.73 22.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.711 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.9 155.09 23.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.775 0.321 . . . . 0.0 110.963 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.618 ' HE2' HG11 ' A' ' 7' ' ' VAL . 8.7 mtmt -60.51 -30.16 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.769 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.35 -59.07 5.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.272 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.647 ' OD2' HG23 ' A' ' 172' ' ' VAL . 4.8 p-10 -81.39 -0.18 40.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.404 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.457 ' CZ ' ' HE2' ' A' ' 181' ' ' LYS . 8.7 t80 -61.67 -65.74 0.64 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.939 0.399 . . . . 0.0 110.657 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -57.21 -26.77 61.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.128 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 59.0 m -75.4 -22.84 57.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.339 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' ALA . . . . . 0.529 ' HB3' ' HZ3' ' A' ' 181' ' ' LYS . . . -97.01 -32.19 12.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' LYS . . . . . 0.529 ' HZ3' ' HB3' ' A' ' 180' ' ' ALA . 0.0 OUTLIER -171.93 -177.27 1.89 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.866 179.892 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 8' ' ' MET . 12.9 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.595 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -129.42 -175.04 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.723 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.519 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.6 p -154.98 134.48 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.16 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.443 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.0 t -58.15 146.12 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.46 -169.35 12.6 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.482 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -60.35 146.19 84.78 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.565 0.221 . . . . 0.0 110.687 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.876 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.4 Cg_exo -77.89 129.96 10.18 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.57 2.18 . . . . 0.0 112.238 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.75 154.61 35.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.441 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -138.73 173.72 11.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.143 0.497 . . . . 0.0 111.555 -179.631 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.444 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.69 -50.57 32.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.979 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.649 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 59.46 96.1 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.76 -66.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.562 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 60.79 95.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' CE1' ' A' ' 115' ' ' PHE . 11.0 p90 -58.71 -32.6 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.67 129.88 2.71 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.491 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.601 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.0 p30 -58.01 -28.38 64.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.737 0.304 . . . . 0.0 111.124 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -64.48 -51.13 64.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.114 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.43 -36.44 71.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.076 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.415 ' HG3' ' CE2' ' A' ' 102' ' ' PHE . 31.3 mm-40 -72.74 176.03 5.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.83 100.0 4.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.808 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -101.4 144.03 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.95 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.695 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.8 pt -63.01 148.15 11.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -118.02 106.88 13.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -77.23 101.86 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.642 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -138.49 160.22 40.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.018 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -74.3 119.63 18.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.45 -28.41 66.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.011 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m 63.48 34.14 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -130.53 76.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -98.66 31.41 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.924 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -152.15 78.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.095 -179.991 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.757 0.313 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -51.58 164.68 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.524 2.149 . . . . 0.0 112.334 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 59.24 31.36 21.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.573 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -109.97 134.91 20.55 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.448 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.9 Cg_endo -60.94 125.91 18.29 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.422 2.081 . . . . 0.0 112.122 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.59 140.6 29.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.074 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.8 164.29 2.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -85.83 114.63 22.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.33 -73.03 0.38 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.613 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -100.26 153.63 19.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.822 0.344 . . . . 0.0 111.004 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.08 86.51 2.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.03 133.6 0.12 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.573 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.4 p80 -70.55 161.0 31.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.59 ' C ' HD23 ' A' ' 71' ' ' LEU . 9.6 mm -94.5 153.67 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.99 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.925 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.12 170.27 7.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -74.18 0.33 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.673 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.94 91.7 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.661 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.603 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.95 140.79 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.603 ' H ' HD13 ' A' ' 75' ' ' ILE . 7.6 mp -89.87 106.9 18.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.584 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -90.77 115.02 27.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.564 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -156.5 156.78 34.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.275 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.817 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 61.69 36.34 16.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.056 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.18 29.9 17.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -168.21 -178.45 3.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.413 ' HB2' HD12 ' A' ' 75' ' ' ILE . 26.2 p-80 -100.11 125.29 46.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.817 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.0 m95 -114.34 132.82 56.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.826 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.454 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.64 172.2 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.12 -40.12 28.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -91.0 -29.78 17.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.22 -30.92 70.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.763 HD23 ' O ' ' A' ' 97' ' ' LEU . 9.7 tp -72.29 77.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -135.6 165.72 24.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.78 138.44 41.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.84 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -29.58 68.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.914 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -105.08 -59.79 1.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -61.43 -39.9 92.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 58.48 22.29 9.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.02 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.6 m -85.78 156.25 58.46 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.219 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -59.66 118.9 5.84 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.607 2.205 . . . . 0.0 112.159 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.8 mp -112.96 54.89 0.71 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.712 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.429 ' C ' HD11 ' A' ' 28' ' ' ILE . . . -97.76 30.21 3.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.138 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.448 ' N ' HD11 ' A' ' 28' ' ' ILE . 22.2 mt-10 -141.48 -47.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.85 135.7 38.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.695 ' HB2' HG23 ' A' ' 28' ' ' ILE . 1.5 t -121.44 170.94 9.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.502 ' CZ ' ' CD2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -176.97 120.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.609 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t -131.72 157.72 43.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.876 0.37 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -170.22 124.0 0.72 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.887 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 -94.27 1.96 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.497 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -147.87 36.01 0.85 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.801 0.334 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.6 m -159.42 -176.88 6.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.535 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.6 p -136.3 116.19 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.129 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -110.47 166.87 10.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 22.6 p -90.83 168.07 11.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.685 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 0.1 OUTLIER -56.35 -44.92 80.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.962 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 12.2 t70 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -77.82 -21.0 52.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.35 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.502 ' CD2' ' CZ ' ' A' ' 102' ' ' PHE . 11.6 t80 -67.99 -44.08 77.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.368 . . . . 0.0 110.891 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 18.1 m-85 -60.67 -41.4 95.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -81.27 -30.43 34.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.351 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -80.96 -54.05 5.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.288 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -105.58 -43.09 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.104 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.53 164.71 11.28 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.487 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 16' ' ' MET . 85.8 m -60.72 155.08 19.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.774 0.321 . . . . 0.0 110.719 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -140.28 172.51 12.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.07 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.492 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.6 t -85.34 130.57 34.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.17 28.42 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.739 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.16 -53.76 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.78 -16.09 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.234 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.8 71.74 0.42 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.898 0.38 . . . . 0.0 110.81 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.437 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -128.09 -164.57 1.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -104.72 107.03 2.82 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.721 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.654 ' CG2' HD11 ' A' ' 15' ' ' LEU . 8.5 mt -87.89 127.35 58.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.4 0.143 . . . . 0.0 110.622 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 52.1 Cg_exo -53.14 177.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.241 1.96 . . . . 0.0 112.316 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.23 -49.16 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.082 2.522 . . . . 0.0 113.554 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.649 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.6 m -126.07 21.9 7.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.612 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -53.35 -175.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.328 . . . . 0.0 110.692 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.928 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -125.48 109.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 111.069 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.653 HG21 ' O ' ' A' ' 143' ' ' TYR . 14.5 p -156.95 160.34 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.87 138.13 34.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.652 179.896 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.412 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.3 OUTLIER -104.91 136.01 45.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.979 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.6 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.83 96.65 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.556 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 54.38 -87.16 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.087 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -96.88 -48.17 5.55 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.823 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.679 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.3 m-85 -84.4 163.01 19.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.644 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.43 HG11 ' CD1' ' A' ' 129' ' ' ILE . 9.9 p -108.62 151.31 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.708 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.739 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -129.01 170.21 13.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.945 0.403 . . . . 0.0 111.299 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.7 m80 -97.56 140.19 32.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.955 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.928 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.07 -21.26 44.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.565 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -91.13 -38.66 12.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.306 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -98.73 12.45 35.48 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.864 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 53.5 t80 -101.56 101.63 12.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -158.94 177.76 10.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 45.2 t -86.48 150.18 24.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.605 HG11 ' HG2' ' A' ' 170' ' ' ARG . 27.6 m -72.17 -36.69 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.317 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.597 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -88.4 -56.94 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.498 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.6 m -65.87 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.159 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? 59.66 32.84 21.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.943 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -128.97 153.01 47.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.03 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.594 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.8 mt-30 -72.16 174.54 7.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.714 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.8 OUTLIER -128.12 173.31 10.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.847 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 163.51 35.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.963 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.2 t -46.8 129.36 11.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.245 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 101.85 -25.31 28.38 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.464 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.519 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.6 t70 -70.45 129.18 38.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.821 0.343 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.95 122.0 31.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.04 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.595 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 5.4 p90 -139.25 155.45 47.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.955 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.451 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 34.4 m-85 -103.02 171.08 7.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.612 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.6 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -130.3 114.46 15.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.4 mmt -70.73 -178.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.11 -28.71 60.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -97.58 28.96 3.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.057 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.07 43.63 24.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.021 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.605 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.1 OUTLIER -100.72 124.09 45.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.864 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -74.66 120.83 20.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.726 HG23 ' OD2' ' A' ' 176' ' ' ASP . 12.5 p -145.3 127.39 9.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.1 m -72.34 -173.19 1.05 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.889 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.435 ' CE ' HG21 ' A' ' 7' ' ' VAL . 12.7 mttt -85.94 -32.24 21.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.84 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.42 -52.33 54.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.15 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.726 ' OD2' HG23 ' A' ' 172' ' ' VAL . 7.2 p-10 -85.21 3.98 36.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.429 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.451 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.6 t80 -59.17 -66.05 0.57 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.964 0.411 . . . . 0.0 110.763 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.32 -27.89 57.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 85.9 m -77.83 -35.43 51.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' ALA . . . . . 0.499 ' HB2' ' CG2' ' A' ' 152' ' ' VAL . . . -97.11 4.04 51.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.579 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.3 -177.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 110.862 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.914 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 12.0 p . . . . . 0 N--CA 1.457 -0.096 0 CA-C-O 120.851 0.358 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.07 -177.12 5.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.69 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.557 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.4 p -154.97 135.09 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.141 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 163' ' ' PHE . 47.9 t -59.27 146.17 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.63 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.88 -169.11 11.98 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.482 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.4 mm-40 -56.3 135.5 75.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.549 0.214 . . . . 0.0 110.744 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.636 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.2 Cg_exo -64.54 135.62 46.54 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.382 2.054 . . . . 0.0 112.385 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -162.94 147.69 11.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.544 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.757 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -117.77 173.35 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.109 0.48 . . . . 0.0 111.285 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.62 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -60.58 -36.24 78.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.721 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.916 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 57.66 74.88 0.29 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.09 -60.96 0.48 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.478 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 62.61 97.68 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.494 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -59.22 -166.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.899 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.43 147.44 19.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -84.03 -35.74 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.98 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -89.5 7.12 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.18 -31.22 34.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 33.4 tp10 -109.66 164.25 12.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -75.97 99.96 4.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.951 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 101' ' ' CYS . 2.0 tp -79.72 165.07 23.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.813 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.6 pt -62.89 164.16 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.464 HG22 ' HG ' ' A' ' 31' ' ' LEU . 59.5 m -126.82 107.07 9.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.774 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.99 101.78 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.547 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.09 151.26 36.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.952 -179.803 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -82.04 156.97 24.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -115.7 144.44 43.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 p -96.85 40.02 1.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 38' ' ' ALA . 0.2 OUTLIER -87.53 -70.29 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 63.7 -79.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.007 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -69.82 -75.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.414 ' HB2' ' CG ' ' A' ' 35' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.132 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.742 0.306 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.45 169.0 18.09 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.534 2.156 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 58.41 29.09 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.834 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.447 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.2 tp -99.49 135.5 20.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 11.8 Cg_endo -56.39 125.93 20.65 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.407 2.071 . . . . 0.0 112.047 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.12 137.94 31.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.3 p -58.37 164.22 2.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.881 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.25 114.63 24.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.27 -71.48 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.66 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.5 p -103.48 155.68 18.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.37 88.3 3.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.112 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -178.44 136.62 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.556 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.4 p-80 -73.67 157.13 37.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.009 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.528 HD11 ' CD2' ' A' ' 84' ' ' HIS . 3.9 mm -88.77 151.55 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.556 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.8 OUTLIER -176.92 37.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.019 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -103.36 179.91 4.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -39.8 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.713 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -109.21 110.22 21.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.446 HG22 ' N ' ' A' ' 76' ' ' LEU . 40.9 mm -120.0 154.79 22.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.389 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.446 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.53 107.06 15.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.093 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.7 119.0 30.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.01 162.71 41.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.148 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.733 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 57.01 36.32 27.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 62.54 30.38 17.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.009 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 21.0 mtt180 -164.2 -178.99 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.015 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 32.9 p-80 -98.8 121.24 40.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.022 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.733 ' NE1' HD12 ' A' ' 79' ' ' LEU . 46.1 m95 -112.48 130.46 55.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.528 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.39 171.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.881 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -79.93 -41.08 26.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.991 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -89.77 -28.61 19.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.016 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.83 -30.78 68.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 97' ' ' LEU . 8.1 tp -72.14 80.39 0.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mmtt -144.63 141.12 29.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.914 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 11.6 t -59.8 132.45 54.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.1 m -77.85 -4.3 45.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.504 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -111.31 -31.8 6.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.065 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 95' ' ' VAL . 14.1 m -111.87 -30.48 7.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.149 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 60.77 25.26 15.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.944 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 93' ' ' CYS . 3.5 m -85.27 159.84 55.61 Favored Pre-proline 0 N--CA 1.453 -0.299 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.213 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.494 ' O ' HD12 ' A' ' 97' ' ' LEU . 35.7 Cg_exo -59.9 121.2 9.45 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.685 2.257 . . . . 0.0 112.312 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.669 ' O ' HD23 ' A' ' 88' ' ' LEU . 5.6 mp -124.55 30.48 5.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.698 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.49 61.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.555 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.813 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.4 mt-10 -92.04 -39.9 11.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.994 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.465 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -140.17 170.74 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.893 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.742 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.3 t -150.89 156.16 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.8 t80 -157.94 119.91 3.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.79 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.466 ' HB3' HD22 ' A' ' 79' ' ' LEU . 10.8 t -130.83 162.27 29.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 4.2 mmm-85 -153.63 124.04 7.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.77 -78.54 0.74 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -133.91 -74.29 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.778 0.323 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 m -59.8 164.66 3.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.3 p -107.3 115.93 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.65 120.89 39.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.799 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 27.3 p -60.09 170.51 1.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.11 -31.88 50.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.196 -179.739 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -50.82 -58.01 7.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.438 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.53 -20.97 58.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.494 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 9.5 t80 -60.14 -26.97 66.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.675 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -79.28 -44.3 21.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.956 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -85.29 -62.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.721 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.05 -50.77 72.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.78 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 6.0 m-85 -88.29 -43.03 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.684 0.278 . . . . 0.0 111.362 -179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.76 -168.36 36.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.432 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.62 HG21 ' SD ' ' A' ' 16' ' ' MET . 24.3 m -58.95 148.69 29.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -151.38 162.22 41.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.803 ' HB2' HD11 ' A' ' 129' ' ' ILE . 42.5 t -79.83 127.6 32.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.943 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.55 30.67 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -124.99 -56.39 1.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.058 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.74 -22.43 11.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.11 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 71.47 73.22 0.18 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.957 0.408 . . . . 0.0 110.912 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.443 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -128.53 -164.54 1.39 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.807 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -109.38 106.11 2.16 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.616 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.803 HD11 ' HB2' ' A' ' 122' ' ' CYS . 2.4 mt -94.97 128.02 40.75 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.448 0.166 . . . . 0.0 110.657 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.619 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.7 Cg_exo -52.25 175.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.196 1.931 . . . . 0.0 112.197 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.37 -47.3 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.646 2.23 . . . . 0.0 113.871 -179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.916 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.53 21.91 7.73 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.177 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.654 HE21 HG23 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -56.73 -170.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.594 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.636 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.15 108.66 23.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.751 0.31 . . . . 0.0 110.544 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.757 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.2 p -157.19 161.72 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.167 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.543 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 135.06 39.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.246 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.722 ' HB3' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -115.65 144.43 43.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.088 -179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.815 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -84.45 96.67 9.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.422 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 43.44 -89.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.529 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.1 m-20 -84.61 -44.5 13.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.749 -177.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 169' ' ' SER . 7.2 m-85 -91.64 167.21 12.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.473 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.722 HG23 ' HB3' ' A' ' 137' ' ' ARG . 9.3 p -124.61 119.78 57.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.901 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 6.0 m-85 -102.98 138.7 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.443 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 64.4 m80 -60.82 141.27 57.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.677 HD23 ' HB ' ' A' ' 135' ' ' VAL . 0.4 OUTLIER -61.29 -18.79 60.23 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.433 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -88.24 -36.7 16.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.912 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.9 OUTLIER -100.89 21.27 13.94 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.447 -179.676 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.702 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 5.6 t80 -89.8 109.75 20.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.841 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.08 157.71 4.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.959 0.409 . . . . 0.0 111.259 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.16 150.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 171' ' ' LEU . 10.8 m -91.09 22.47 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.508 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 39.2 t -136.74 -62.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.813 0.339 . . . . 0.0 110.618 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.9 p -85.02 -20.83 29.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.653 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 65.01 61.75 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.193 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -129.13 137.58 51.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.071 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 157' ' ' LEU . 13.5 mt-30 -68.17 154.06 42.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.725 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.4 OUTLIER -122.68 147.1 46.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.64 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -127.54 165.89 19.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.0 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -46.05 128.2 9.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.206 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.17 -26.67 22.24 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.557 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.5 m-20 -70.82 128.96 37.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.813 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -87.99 118.84 27.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.035 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.686 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.2 p90 -135.63 151.28 50.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 174' ' ' LYS . 26.0 m-85 -97.06 171.01 8.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.795 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.815 HD11 ' HB1' ' A' ' 138' ' ' ALA . 2.8 tp -132.22 118.39 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.782 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.7 mmt -56.38 164.26 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -58.2 -30.46 66.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.159 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.92 -79.04 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.994 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' SER . . . . . 0.437 ' HB3' ' CE1' ' A' ' 141' ' ' PHE . 36.5 p 178.99 77.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.804 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.582 ' CG ' HG11 ' A' ' 151' ' ' VAL . 7.6 mtt180 -144.5 119.38 9.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.702 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -66.92 121.43 15.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.841 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -139.09 140.76 37.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.001 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.31 160.99 14.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 164' ' ' TYR . 9.4 mttp -58.12 -46.84 84.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.136 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.35 -27.15 62.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.308 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -104.07 -6.87 20.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.447 ' CE2' ' CB ' ' A' ' 182' ' ' GLN . 8.3 t80 -56.2 -66.04 0.5 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.843 0.354 . . . . 0.0 110.986 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.6 -31.37 72.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.928 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -31.5 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.873 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -78.29 -52.02 9.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.13 -67.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.947 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 182' ' ' GLN . . . . . 0.447 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.922 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.487 HG22 ' N ' ' A' ' 8' ' ' MET . 14.2 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.784 0.326 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.597 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -140.95 179.18 6.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.716 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.523 HG23 ' C ' ' A' ' 161' ' ' ASP . 7.3 p -155.11 133.81 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.1 t -54.8 146.31 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.662 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.488 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -143.23 -140.76 3.73 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.702 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 24.3 mt-10 -72.96 117.04 56.47 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.527 0.204 . . . . 0.0 110.865 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.92 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.03 137.51 52.87 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.388 2.059 . . . . 0.0 112.115 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.05 153.96 16.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.787 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.814 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -124.86 173.47 8.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.109 0.481 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.408 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.09 -28.42 68.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.692 179.588 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.926 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.35 61.05 7.82 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.527 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.65 -67.13 1.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.545 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 65.92 67.72 0.47 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.946 0.403 . . . . 0.0 110.739 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -75.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.03 153.8 30.59 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.06 -34.19 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -62.05 -31.17 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -68.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 102' ' ' PHE . 67.5 mm-40 -65.1 175.99 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 119.05 19.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.44 HD11 ' CB ' ' A' ' 100' ' ' ARG . 1.7 tp -103.68 165.05 11.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.914 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.853 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.9 pt -62.88 146.89 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.168 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.6 m -113.62 106.86 15.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 76' ' ' LEU . 1.3 tpp180 -77.61 101.83 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.59 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.05 166.06 26.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.961 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.43 157.03 23.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.1 -29.1 9.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.885 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.71 36.84 13.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.915 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -133.83 77.45 1.71 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 73' ' ' ARG . 47.1 m-85 -80.62 -74.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.87 86.43 4.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.061 -179.978 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.101 0 CA-C-O 120.655 0.264 . . . . 0.0 110.835 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.95 165.86 1.09 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.522 2.148 . . . . 0.0 112.173 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 58.3 30.56 19.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.833 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.496 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -107.45 135.22 19.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.991 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.429 ' HD2' HD12 ' A' ' 60' ' ' ILE . 21.9 Cg_endo -62.27 125.9 17.37 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.359 2.04 . . . . 0.0 112.021 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.79 150.69 22.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.7 t -58.52 140.51 53.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.711 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -62.1 114.85 3.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.71 28.77 45.62 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.98 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.65 -178.9 5.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.876 0.369 . . . . 0.0 110.849 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.6 -28.35 10.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.52 -167.58 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.496 ' CD2' HG21 ' A' ' 60' ' ' ILE . 6.2 p80 -107.54 171.76 7.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.971 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.513 ' C ' HD23 ' A' ' 71' ' ' LEU . 10.4 mm -91.57 153.48 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.059 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.513 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.84 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.826 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.586 ' HB2' HD11 ' A' ' 75' ' ' ILE . 11.1 m-20 -100.36 -178.9 3.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.926 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 36' ' ' PHE . 15.2 tpt180 -86.88 -70.11 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.986 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.596 ' C ' HD12 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -81.35 105.66 12.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.111 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.596 HD12 ' C ' ' A' ' 74' ' ' PHE . 1.3 mp -113.12 153.8 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.825 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 30' ' ' ARG . 8.6 mp -104.79 111.95 24.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.797 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -90.95 139.03 31.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.982 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -176.7 150.59 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.119 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.3 OUTLIER 58.64 37.26 25.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 62.09 30.35 17.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.111 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -166.33 167.97 15.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.895 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -92.45 117.96 30.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.646 ' CB ' HD13 ' A' ' 88' ' ' LEU . 69.3 m95 -105.73 125.13 50.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.67 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 175.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.955 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t -77.29 -42.08 38.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.898 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 ttpm? -91.14 -34.09 15.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 30.6 m -67.48 -28.2 67.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 83' ' ' TRP . 48.7 tp -72.8 89.18 1.35 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.908 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.3 mttt -152.93 155.94 37.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -59.9 146.97 40.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 m -73.1 -30.98 64.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 -60.51 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.96 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.414 ' HB2' HG22 ' A' ' 95' ' ' VAL . 35.2 m -59.73 -34.25 72.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 57.77 22.25 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.097 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.442 HG23 HD11 ' A' ' 97' ' ' LEU . 4.2 m -85.18 156.33 60.13 Favored Pre-proline 0 N--CA 1.453 -0.284 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.38 118.97 6.0 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.471 2.114 . . . . 0.0 112.253 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.568 ' O ' HD23 ' A' ' 88' ' ' LEU . 11.2 mp -111.43 60.8 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.85 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.68 36.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.081 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -153.42 -46.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.881 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.44 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -128.4 138.57 52.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.919 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.853 ' HB2' HG23 ' A' ' 28' ' ' ILE . 49.4 t -131.06 156.97 44.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 104' ' ' ARG . 13.5 t80 -169.08 119.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.74 ' HB2' HD22 ' A' ' 79' ' ' LEU . 10.7 t -97.27 153.18 18.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.44 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -176.71 124.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.871 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.89 41.07 24.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 59.52 31.4 20.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.857 0.361 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.6 m -161.62 165.79 27.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.858 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.543 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.7 p -85.47 115.99 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.058 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -125.63 120.93 32.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.935 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.1 p -69.9 163.61 25.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -78.14 -24.96 47.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.353 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.436 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -55.56 -58.16 8.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 111.284 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -73.32 -20.75 60.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.254 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.444 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 32.9 t80 -61.98 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.7 m-85 -72.88 -44.79 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -79.89 -31.85 40.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.055 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -57.84 2.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.062 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 23.8 m-85 -99.04 31.13 3.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.973 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.14 169.06 32.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.404 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 86.2 m -59.78 153.56 20.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.765 0.317 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -154.9 170.66 21.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.03 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 18.8 t -81.22 137.96 35.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.82 14.03 16.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.51 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.09 -41.54 2.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.937 0.399 . . . . 0.0 111.064 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.8 m -105.9 -20.58 13.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.095 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 64.31 29.27 13.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.746 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tp -99.58 150.02 22.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.812 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.93 96.59 0.6 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.652 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.458 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 5.2 mt -59.86 140.32 90.02 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.478 0.18 . . . . 0.0 110.678 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.645 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.6 Cg_exo -48.24 175.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.301 2.001 . . . . 0.0 112.11 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.443 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.5 Cg_endo -77.38 -55.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.365 2.043 . . . . 0.0 113.948 -179.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.926 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -122.36 21.72 10.23 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.271 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.645 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.9 OUTLIER -60.07 139.07 57.71 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.649 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.92 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -74.89 108.71 6.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.826 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.814 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.0 p -151.78 161.07 3.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.12 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.81 141.86 29.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.859 0.361 . . . . 0.0 110.591 179.858 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.56 ' HG2' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.87 130.03 53.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.975 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.695 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -82.56 96.67 8.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.739 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.628 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.86 -86.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.451 0.644 . . . . 0.0 111.855 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -100.23 -48.41 4.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.954 -177.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -91.34 174.67 7.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.759 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.56 HG22 ' HG2' ' A' ' 137' ' ' ARG . 32.5 t -121.43 150.23 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.703 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.695 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 2.6 m-85 -131.34 138.99 49.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.423 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 70.1 m80 -55.12 144.93 22.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.846 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -64.3 -17.85 64.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.225 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.93 -38.34 14.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.078 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.8 p -95.48 25.21 4.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.531 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.832 ' CE1' HD11 ' A' ' 171' ' ' LEU . 0.9 OUTLIER -104.36 112.24 25.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.8 0.333 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.442 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.03 160.59 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.123 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -59.7 150.04 28.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 152' ' ' VAL . 6.5 m -67.31 -27.31 38.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.343 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 151' ' ' VAL . 20.1 t -108.54 -55.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.36 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 40.3 m -66.04 -28.0 68.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.078 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' LYS . . . . . 0.442 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 9.8 mmtt 55.21 36.78 27.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.997 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -109.8 137.79 47.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.2 mt-30 -64.02 154.42 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.0 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.696 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.4 mm? -113.79 163.85 14.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.703 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 170.92 15.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.488 HG23 ' HA2' ' A' ' 11' ' ' GLY . 4.4 m -44.69 123.03 3.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.501 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.92 -24.36 32.56 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.679 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.523 ' C ' HG23 ' A' ' 9' ' ' VAL . 5.0 t0 -67.07 128.98 38.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.744 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.482 ' HA ' HG23 ' A' ' 9' ' ' VAL . 5.1 mt-10 -87.87 128.95 35.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.142 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.597 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 12.5 p90 -143.43 141.11 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.601 ' HB2' HG13 ' A' ' 172' ' ' VAL . 14.8 m-85 -97.96 171.07 8.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.796 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.628 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.5 tp -131.73 110.99 11.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.792 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 5.7 mmt -60.98 172.32 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -66.11 -30.22 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -98.21 29.18 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.44 84.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.974 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.434 ' CG ' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -149.49 129.54 13.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.914 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.832 HD11 ' CE1' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -73.74 126.11 29.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.601 HG13 ' HB2' ' A' ' 164' ' ' TYR . 11.3 p -145.06 135.75 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 29.6 p -80.29 167.23 20.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.875 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -57.54 -49.64 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.066 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.6 63.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -94.98 -15.45 23.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.261 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 7.7 t80 -55.58 -66.04 0.49 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.053 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.2 -29.5 70.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 4.3 m -72.81 -33.3 66.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.029 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.6 -30.88 15.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.201 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm 61.44 175.77 0.11 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.495 HG22 ' N ' ' A' ' 8' ' ' MET . 14.0 p . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.794 0.331 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.495 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -131.53 -175.62 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.7 p -155.03 139.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.263 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.465 HG22 ' CE1' ' A' ' 163' ' ' PHE . 39.8 t -66.55 146.09 13.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.665 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.01 -167.21 12.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.49 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 11.0 mt-10 -62.58 149.84 87.63 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.628 0.251 . . . . 0.0 110.832 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.1 Cg_endo -83.01 136.08 7.86 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.848 2.365 . . . . 0.0 112.399 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.06 142.89 5.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.301 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.752 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -117.95 173.46 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.409 -179.639 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.62 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.27 -44.21 92.46 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.005 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.831 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 60.13 102.45 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.436 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.12 -44.69 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.567 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 62.77 20.51 12.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.66 0.267 . . . . 0.0 110.978 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.496 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 55.54 -173.95 0.05 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.822 0.344 . . . . 0.0 111.047 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.57 152.32 16.84 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.1 -31.08 25.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.912 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -88.14 7.05 33.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.427 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.85 -67.97 0.42 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.9 tp10 -110.83 176.06 5.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.907 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 136.89 40.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mp -111.96 165.06 12.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.874 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.759 HG21 HD21 ' A' ' 88' ' ' LEU . 6.5 pt -62.94 135.19 27.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -99.24 106.87 19.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.741 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD2' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.64 101.83 11.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.471 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.461 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.47 163.03 35.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.986 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -86.59 150.9 23.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.931 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -98.31 -31.37 12.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.936 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 m 60.26 31.66 20.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.31 -73.09 0.49 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 73' ' ' ARG . 5.2 m-85 64.17 -78.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.983 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -74.94 111.49 10.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 179.967 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.112 0 CA-C-O 120.667 0.27 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.38 165.64 26.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.175 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 58.36 29.82 18.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.767 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.452 HD12 ' HD2' ' A' ' 61' ' ' PRO . 2.9 tp -103.02 135.66 19.36 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' HD12 ' A' ' 60' ' ' ILE . 19.3 Cg_endo -59.88 125.92 19.01 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.408 2.072 . . . . 0.0 111.891 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.55 149.01 21.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.4 t -58.22 137.39 57.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.705 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.448 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -61.06 114.76 3.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.266 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.47 28.38 39.91 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.914 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.54 -178.86 5.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.837 0.351 . . . . 0.0 110.96 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.9 -28.79 9.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.691 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.26 -165.94 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.703 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -110.76 154.56 23.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.008 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.7 mm -66.92 153.72 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.404 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.4 OUTLIER -168.83 33.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.783 -179.858 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -109.38 -178.97 3.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -95.13 -35.73 11.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.582 ' O ' HD13 ' A' ' 75' ' ' ILE . 1.9 m-85 -105.03 115.68 30.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.055 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.1 mm -133.62 153.88 37.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.229 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.9 mp -113.18 107.93 16.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.278 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -90.77 123.21 34.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.043 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.725 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.48 162.19 35.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.051 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.65 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 57.85 35.47 25.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.47 40.76 10.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.02 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.45 171.13 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -93.2 117.92 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.65 ' NE1' HD12 ' A' ' 79' ' ' LEU . 73.5 m95 -109.72 125.41 52.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.791 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 176.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.957 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.01 -42.01 24.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.13 -15.56 29.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.113 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.5 m -96.74 26.16 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.734 0.302 . . . . 0.0 111.083 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.759 HD21 HG21 ' A' ' 28' ' ' ILE . 2.8 tp -124.06 29.55 6.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 152.21 20.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.16 147.03 52.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -66.56 -29.61 69.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.032 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -106.13 -58.38 1.92 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 17.0 m -59.92 -37.67 80.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 58.0 22.58 9.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.028 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -87.01 155.9 55.12 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.151 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.21 118.94 5.75 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.513 2.142 . . . . 0.0 112.339 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.457 HD23 ' SG ' ' A' ' 101' ' ' CYS . 8.8 mp -101.81 70.69 1.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.89 35.19 1.75 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.108 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.545 ' C ' HD11 ' A' ' 28' ' ' ILE . 31.2 mm-40 -152.42 -48.51 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -149.41 157.76 43.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.909 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HD23 ' A' ' 97' ' ' LEU . 20.0 t -157.02 128.0 6.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.9 m-85 -98.45 171.96 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.562 ' HB2' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -155.59 140.43 17.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.874 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -153.64 124.0 7.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.818 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.34 -122.84 15.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.536 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -113.07 36.08 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 165.53 29.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.527 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.3 p -117.07 116.0 50.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.13 159.38 21.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.7 p -100.92 176.76 5.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.793 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.16 -29.44 48.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.332 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.79 -58.05 9.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -71.27 -20.89 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.293 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 5.9 t80 -65.67 -30.11 70.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 111.144 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 4.0 m-85 -79.08 -44.44 22.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.1 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -79.26 -41.8 27.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.212 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -83.02 -55.72 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.259 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -96.99 37.07 1.34 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.914 0.387 . . . . 0.0 111.139 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -156.45 -167.38 17.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.455 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.612 HG21 ' SD ' ' A' ' 16' ' ' MET . 2.4 m -59.79 150.05 29.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.786 0.327 . . . . 0.0 110.902 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -153.65 175.5 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.882 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.614 ' HB2' HD11 ' A' ' 129' ' ' ILE . 47.2 t -88.0 132.1 34.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.992 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.4 27.45 4.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.037 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.87 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -55.34 1.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.964 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 23.7 p -111.16 -17.44 13.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.169 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 66.45 73.68 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.873 0.368 . . . . 0.0 110.882 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.453 ' CB ' ' CE1' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -127.97 -163.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.731 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -111.34 97.0 0.92 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.734 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.701 HG22 HD11 ' A' ' 15' ' ' LEU . 1.7 mt -82.03 129.31 64.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.426 0.155 . . . . 0.0 110.63 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 77.5 Cg_exo -48.5 173.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.281 1.987 . . . . 0.0 112.337 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.1 Cg_endo -77.48 -47.54 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.558 2.172 . . . . 0.0 113.892 -179.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.831 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.2 m -126.22 21.85 7.29 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -56.18 -171.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.539 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.766 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -121.02 108.3 22.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.782 0.325 . . . . 0.0 110.554 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.752 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.6 p -157.41 156.06 4.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.276 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.45 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.68 139.24 33.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.59 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.85 129.43 53.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.92 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -64.41 96.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.515 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.45 -88.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.857 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -88.8 -42.15 12.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.991 -1.004 . . . . 0.0 112.53 -177.03 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 5.2 m-85 -99.58 166.34 11.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.052 0.453 . . . . 0.0 112.12 -178.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.1 p -105.17 147.48 10.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.633 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.87 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 17.8 m-85 -132.62 142.59 49.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.881 0.372 . . . . 0.0 111.353 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 127' ' ' LEU . 66.4 m80 -70.4 145.08 51.33 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.02 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.766 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.2 OUTLIER -64.97 -17.74 64.66 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.228 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -88.48 -46.48 9.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.544 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 2.5 p -84.83 -33.73 22.83 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.806 ' CE1' HD21 ' A' ' 171' ' ' LEU . 36.8 t80 -56.99 99.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.88 0.371 . . . . 0.0 110.972 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.01 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.108 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 150.01 26.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.943 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.836 HG13 ' O ' ' A' ' 171' ' ' LEU . 23.7 m -70.44 -30.56 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.154 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.784 HG23 HG23 ' A' ' 151' ' ' VAL . 19.8 t -106.99 -51.5 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.125 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 42.5 m -66.05 -28.14 68.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 24.0 mttp 54.84 39.62 31.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.03 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -127.84 141.83 51.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.907 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.497 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.8 mt-30 -61.93 166.2 4.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.714 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.8 OUTLIER -122.44 172.21 8.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 164.61 31.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.07 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -47.16 128.82 12.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.317 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.08 21.79 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.469 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.7 m-20 -66.35 128.91 38.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.631 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -90.48 117.34 29.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.13 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.687 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.0 p90 -133.75 168.27 19.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.848 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.696 ' HB2' HG13 ' A' ' 172' ' ' VAL . 61.4 m-85 -114.71 171.03 7.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.768 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.71 123.2 30.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 10.2 mmt -83.13 168.74 16.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.971 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -59.75 -28.49 67.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.012 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -97.35 28.16 3.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.1 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.38 38.53 28.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.43 141.73 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.836 ' O ' HG13 ' A' ' 151' ' ' VAL . 0.3 OUTLIER -90.31 125.08 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.967 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.696 HG13 ' HB2' ' A' ' 164' ' ' TYR . 12.3 p -145.11 130.24 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.46 -173.44 4.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.023 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -61.08 2.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.08 -23.56 47.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.366 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.695 ' HB3' HG23 ' A' ' 172' ' ' VAL . 85.4 m-20 -89.98 -23.38 21.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.063 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.502 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.1 t80 -54.54 -66.03 0.47 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.839 0.352 . . . . 0.0 111.045 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -55.56 -26.18 42.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.119 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 72.4 m -82.02 -27.66 32.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.12 -20.69 18.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.387 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.72 -178.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.483 HG22 ' N ' ' A' ' 8' ' ' MET . 13.4 p . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.793 0.33 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.483 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -155.95 -177.95 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.595 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.2 p -155.1 131.84 2.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.276 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.51 HG23 ' CD1' ' A' ' 163' ' ' PHE . 52.9 t -55.41 146.16 4.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.464 ' C ' HG23 ' A' ' 159' ' ' THR . . . -128.09 -151.86 7.68 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.739 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -73.69 128.24 87.24 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.473 0.177 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.7 ' HB2' HG12 ' A' ' 134' ' ' VAL . 33.5 Cg_exo -55.94 151.17 42.75 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.27 1.98 . . . . 0.0 112.342 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.04 149.75 7.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.36 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.659 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.0 OUTLIER -144.07 173.49 11.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.225 -179.471 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.402 ' HE1' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -57.17 -52.94 63.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.767 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.588 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 59.18 83.24 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.457 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -167.15 -43.55 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.519 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 63.45 27.3 15.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 0.0 110.774 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.508 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 61.23 -170.19 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.839 -179.983 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.05 150.26 22.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.522 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.739 ' HB3' HD22 ' A' ' 27' ' ' LEU . 40.0 m-20 -83.91 -42.69 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.866 0.365 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.87 -29.15 68.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.29 -74.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.949 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG2' ' CG ' ' A' ' 102' ' ' PHE . 30.5 tp10 -72.92 163.44 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.958 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -76.0 99.94 4.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 22' ' ' ASP . 2.0 tp -77.38 163.25 26.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.906 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.966 HG21 HD21 ' A' ' 88' ' ' LEU . 6.7 pt -62.86 149.28 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.198 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 m -107.78 106.85 17.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.38 101.78 12.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.393 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -150.3 166.1 31.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.936 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -89.73 151.55 21.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.488 ' ND2' ' HB ' ' A' ' 75' ' ' ILE . 0.6 OUTLIER -94.27 -178.57 4.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.855 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.558 ' O ' HG22 ' A' ' 34' ' ' THR . 28.8 m -133.29 35.65 3.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -97.49 -74.43 0.57 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 68.06 -69.64 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -105.7 83.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.885 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.523 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 120.701 0.286 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.76 165.38 1.17 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.493 2.129 . . . . 0.0 112.195 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 58.64 30.66 20.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.521 HD13 ' CD2' ' A' ' 69' ' ' HIS . 8.3 tt -107.95 136.24 19.77 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.995 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HD2' HG13 ' A' ' 60' ' ' ILE . 19.6 Cg_endo -61.57 125.95 17.96 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.288 1.992 . . . . 0.0 111.98 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.6 157.72 15.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.177 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.404 ' HB2' HG12 ' A' ' 70' ' ' ILE . 4.9 t -58.26 142.49 47.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.494 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . . . -62.9 114.75 3.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.27 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.72 28.53 46.55 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.997 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.43 -178.92 5.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.854 0.359 . . . . 0.0 110.944 -179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -109.19 -29.31 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.83 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -104.67 -165.67 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.847 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CD2' HD13 ' A' ' 60' ' ' ILE . 3.7 p80 -106.6 173.42 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.986 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.561 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.3 mm -92.05 153.81 3.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.196 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.561 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -165.8 31.65 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.806 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.33 -178.96 3.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.23 -36.15 11.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.002 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.547 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.3 m-85 -106.72 116.66 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.547 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.9 mm -134.41 154.02 36.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.284 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.6 mp -112.81 108.95 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.291 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.71 123.3 34.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.1 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.711 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -158.32 161.06 37.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.055 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.79 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 57.59 35.83 26.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.017 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 62.63 35.81 14.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.82 168.94 5.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 41.6 p-80 -94.21 117.95 30.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.925 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.79 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 56.2 m95 -110.08 127.23 54.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.709 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.9 175.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.116 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.05 -39.26 30.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.651 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -91.06 -34.67 15.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 9.3 m -71.43 -28.4 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.966 HD21 HG21 ' A' ' 28' ' ' ILE . 57.7 tp -74.56 81.12 1.98 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -147.3 162.35 39.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.874 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.96 147.03 48.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -29.95 60.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.134 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.57 -63.01 1.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.497 ' HB2' HG22 ' A' ' 95' ' ' VAL . 19.4 m -59.31 -32.7 70.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.032 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 56.35 23.03 6.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.151 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.497 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -88.09 147.39 40.49 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.143 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.39 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.503 2.135 . . . . 0.0 112.286 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.4 mp -108.99 65.0 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.741 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.98 30.56 3.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.165 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.666 ' C ' HD11 ' A' ' 28' ' ' ILE . 25.5 mm-40 -140.47 -49.64 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.59 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -139.21 167.37 22.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.819 179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.661 ' HB2' HG23 ' A' ' 28' ' ' ILE . 9.0 t -157.0 127.96 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.984 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.481 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.5 OUTLIER -113.07 156.17 23.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.808 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.4 p -145.33 127.39 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.966 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -149.1 123.99 9.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -92.47 1.81 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.477 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -157.78 36.08 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.805 0.336 . . . . 0.0 110.838 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -154.82 152.16 29.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.876 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.3 p -84.15 115.99 27.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -118.84 158.13 26.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.536 ' HB3' HD21 ' A' ' 97' ' ' LEU . 30.2 p -99.93 171.7 7.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.691 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.04 -32.61 51.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.347 -179.724 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 3.7 t0 -51.53 -58.11 7.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.43 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -73.33 -20.68 60.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.328 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.508 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 8.5 t80 -62.32 -31.53 72.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.864 0.364 . . . . 0.0 110.815 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.3 m-85 -74.22 -35.26 63.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.755 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -85.09 -55.56 3.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.148 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -71.55 -48.26 49.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.348 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 5.4 m-85 -103.27 37.07 2.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.872 0.368 . . . . 0.0 111.087 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.74 173.13 35.07 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.585 HG22 ' CG1' ' A' ' 142' ' ' VAL . 0.2 OUTLIER -59.06 155.03 14.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.717 0.294 . . . . 0.0 110.895 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.408 ' C ' HD11 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -166.15 160.14 15.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.035 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.409 ' N ' HD11 ' A' ' 129' ' ' ILE . 49.6 t -57.9 136.91 57.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.19 19.69 5.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.296 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.3 -48.29 1.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.827 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 1.8 m -111.02 -15.24 13.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.139 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 65.3 29.89 11.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.916 0.389 . . . . 0.0 110.627 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tp -82.62 136.08 34.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.765 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -55.69 99.96 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.731 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.409 HD11 ' N ' ' A' ' 122' ' ' CYS . 46.1 mt -63.37 128.55 92.65 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.476 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 88.1 Cg_exo -44.22 169.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.547 2.165 . . . . 0.0 112.691 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.07 -47.03 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.622 2.214 . . . . 0.0 113.987 -178.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.588 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.11 21.41 8.09 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.659 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.6 146.63 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.7 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -90.56 110.64 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 0.0 111.422 -179.451 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.709 HG23 ' HG ' ' A' ' 145' ' ' LEU . 9.7 p -150.2 163.36 3.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.03 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.486 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 147.14 24.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.554 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.0 129.65 56.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.78 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -64.66 96.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.599 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.484 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 56.97 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.429 0.633 . . . . 0.0 111.686 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.0 m-20 -101.99 -48.75 4.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.776 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -82.06 160.6 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.725 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.585 ' CG1' HG22 ' A' ' 120' ' ' THR . 10.4 p -106.23 153.46 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.58 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.66 173.12 11.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.125 0.488 . . . . 0.0 111.389 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -70.82 163.15 27.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.904 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.709 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -79.8 -31.04 40.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.166 0.507 . . . . 0.0 109.741 178.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.25 -49.19 6.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.815 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 71.4 m -49.9 -38.04 34.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.318 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.786 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.5 OUTLIER -56.97 112.43 1.33 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 111.046 -179.692 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.06 171.73 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.95 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.77 149.98 37.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.93 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 152' ' ' VAL . 9.9 m -75.55 -32.06 24.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.074 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -103.29 -49.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.13 -28.03 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 59.04 41.98 19.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.008 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -129.07 141.15 51.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.995 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -64.11 151.19 43.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.678 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.7 mm? -104.47 162.71 13.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.689 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.96 171.26 15.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.311 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.464 HG23 ' C ' ' A' ' 11' ' ' GLY . 4.9 m -43.98 125.32 4.27 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.609 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.14 -22.49 38.23 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.769 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.471 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.6 t0 -68.55 131.3 45.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.772 0.32 . . . . 0.0 110.778 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.44 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.5 mt-10 -87.88 128.45 35.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.008 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.884 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -145.03 140.56 28.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.127 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.687 ' HB2' HG13 ' A' ' 172' ' ' VAL . 54.1 m-85 -98.09 132.49 43.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.556 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.78 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.9 tp -87.96 111.0 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.839 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.5 mmt -74.77 148.76 40.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.901 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.72 -28.06 67.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.056 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -97.58 34.6 1.81 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 60.5 p 53.53 80.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.432 ' HD3' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -156.17 130.63 8.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.811 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.884 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.6 mp -92.5 128.77 38.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.958 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.687 HG13 ' HB2' ' A' ' 164' ' ' TYR . 6.6 p -144.99 118.84 2.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.2 p -66.56 -172.87 0.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.656 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -77.15 -39.26 49.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.355 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.11 -59.04 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.521 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -74.22 -9.33 58.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.501 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 8.6 t80 -57.05 -66.13 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -63.87 -28.59 69.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.009 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.0 m -77.77 -21.72 51.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.223 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.16 -29.85 13.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.774 0.321 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 181' ' ' LYS . . . . . 0.428 ' HE2' ' CE1' ' A' ' 177' ' ' TYR . 0.1 OUTLIER -170.35 -178.22 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 179.999 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.458 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 9.1 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.797 0.332 . . . . 0.0 111.489 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.421 ' HE3' ' HB2' ' A' ' 8' ' ' MET . 0.0 OUTLIER -131.76 -163.06 1.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 162' ' ' GLU . 9.8 p -147.58 132.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.406 ' CG2' ' CD1' ' A' ' 163' ' ' PHE . 21.6 t -55.58 146.19 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.224 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.418 ' C ' HG23 ' A' ' 159' ' ' THR . . . -124.33 -174.77 14.16 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.371 -0.919 . . . . 0.0 112.908 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 50.9 mt-10 -56.64 137.39 77.49 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.558 0.218 . . . . 0.0 110.935 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.802 ' HB2' HG12 ' A' ' 134' ' ' VAL . 14.7 Cg_exo -67.01 136.99 43.03 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.498 2.132 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.417 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.7 OUTLIER -166.07 142.97 5.22 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.113 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.959 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.6 OUTLIER -116.28 173.89 6.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 111.443 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.44 ' HE2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.36 -38.74 81.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.669 -179.223 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 71.67 55.72 7.22 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.336 -0.935 . . . . 0.0 111.975 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.04 23.24 30.28 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.804 -0.713 . . . . 0.0 113.042 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -51.07 95.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.868 0.366 . . . . 0.0 110.738 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 3.1 m-85 -57.79 -35.25 70.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.828 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.07 176.12 43.43 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.485 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.756 ' HB3' HD22 ' A' ' 27' ' ' LEU . 74.1 m-20 -83.99 -30.79 25.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.844 0.354 . . . . 0.0 110.965 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.17 -31.83 73.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.66 -76.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 32.3 mm-40 -82.78 172.19 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.023 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -76.02 118.16 18.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.756 HD22 ' HB3' ' A' ' 22' ' ' ASP . 3.4 tp -95.71 165.15 12.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.939 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.68 144.21 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.178 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.437 HG22 ' HG ' ' A' ' 31' ' ' LEU . 20.2 m -109.19 106.76 16.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -82.74 101.64 11.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.263 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.1 166.04 28.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.155 -179.563 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.03 145.45 44.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.484 ' ND2' HG21 ' A' ' 70' ' ' ILE . 1.1 t30 -95.02 -167.68 1.67 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.841 HG23 ' HB2' ' A' ' 38' ' ' ALA . 6.2 t -82.35 58.6 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.924 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 pm0 45.26 -169.41 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.569 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 71' ' ' LEU . 4.4 t80 -91.9 -22.9 19.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.013 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -57.61 -20.52 33.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.841 ' HB2' HG23 ' A' ' 34' ' ' THR . . . . . . . . 0 C--N 1.332 -0.189 0 CA-C-O 120.801 0.334 . . . . 0.0 111.479 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 60' ' ' ILE . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.092 0 CA-C-O 120.686 0.279 . . . . 0.0 110.86 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.35 154.61 40.99 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.526 2.15 . . . . 0.0 112.352 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 57.27 28.9 15.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.923 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.636 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -94.64 134.9 24.49 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.031 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 60' ' ' ILE . 13.3 Cg_endo -57.45 125.97 20.48 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.459 2.106 . . . . 0.0 111.981 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.01 146.8 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.148 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.9 t -57.1 155.29 8.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -80.08 114.71 19.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.565 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.38 -59.06 0.38 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.466 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.7 p -96.94 161.31 13.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -91.8 75.62 5.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -178.15 134.0 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.896 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.636 ' CD2' HG21 ' A' ' 60' ' ' ILE . 7.1 p80 -63.94 153.4 37.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.484 HG21 ' ND2' ' A' ' 33' ' ' ASN . 10.3 mm -79.24 151.26 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.401 ' O ' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -157.35 30.61 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -102.99 -178.98 3.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -35.52 8.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.678 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -106.18 107.2 18.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.683 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 37.4 mm -128.92 153.06 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 111.485 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.1 mp -108.6 110.33 21.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.147 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -90.68 126.55 36.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.247 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.769 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.69 165.73 31.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.963 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.667 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 57.07 34.63 25.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.108 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.87 40.18 9.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.088 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -177.53 169.03 2.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.943 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 34.6 p-80 -88.8 120.97 30.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.896 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.667 ' NE1' HD12 ' A' ' 79' ' ' LEU . 55.2 m95 -111.7 128.24 56.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.85 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.46 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.83 167.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.854 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 t -73.3 -39.5 65.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.748 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -91.08 -37.42 13.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.19 -31.53 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.958 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 28' ' ' ILE . 10.9 tp -65.97 85.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -156.1 161.38 40.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.922 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 147.04 40.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.1 m -69.41 -28.82 66.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.048 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.77 -60.19 1.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.9 m -58.69 -39.12 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.034 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 57.48 22.43 8.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.442 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.4 m -85.37 154.39 59.66 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.71 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.486 2.124 . . . . 0.0 112.204 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 95' ' ' VAL . 9.3 mp -111.12 57.88 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.728 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.2 43.19 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -157.43 -62.23 0.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.686 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.99 128.97 41.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.448 ' CB ' HG23 ' A' ' 28' ' ' ILE . 11.0 t -129.89 127.91 41.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 4.2 m-85 -111.48 171.94 7.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.731 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.498 ' HB3' HD22 ' A' ' 79' ' ' LEU . 11.7 p -149.5 137.24 20.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 110.973 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -169.44 123.97 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.842 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.99 17.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.613 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 60.86 38.31 17.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.831 0.348 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -156.18 156.29 33.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.862 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.9 p -78.0 120.72 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.118 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -124.79 151.56 45.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.944 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 24.4 p -103.32 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.436 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.437 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.06 -41.01 36.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.291 -179.653 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -43.53 -58.04 2.82 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.59 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -75.58 -20.49 58.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 20' ' ' PHE . 56.0 t80 -64.32 -35.31 80.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.013 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 33.4 m-85 -67.63 -44.69 77.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.036 0.446 . . . . 0.0 110.87 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -80.49 -32.55 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.314 -179.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -80.82 -56.59 4.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.341 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.432 ' CG ' ' CE1' ' A' ' 114' ' ' PHE . 5.4 m-85 -95.48 -43.06 8.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.155 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -66.58 -150.64 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.3 m -103.18 154.05 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.68 0.276 . . . . 0.0 110.71 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . 0.445 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.0 OUTLIER -137.23 179.36 6.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 111.268 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 129' ' ' ILE . 49.8 t -78.85 141.73 37.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.079 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.15 20.3 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.438 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -49.36 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.893 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 19.9 p -111.22 -17.66 13.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 67.35 47.09 1.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.956 0.408 . . . . 0.0 111.097 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.11 -162.08 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.58 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -117.33 79.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.903 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.499 HD11 ' CA ' ' A' ' 122' ' ' CYS . 2.1 mp -59.53 139.09 89.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.525 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 73.9 Cg_exo -46.84 172.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.248 1.965 . . . . 0.0 111.989 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.418 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.3 Cg_endo -77.13 -55.02 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.305 2.003 . . . . 0.0 113.798 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.84 22.17 9.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.474 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.959 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.55 -166.85 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.521 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -122.77 111.68 31.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.967 0.413 . . . . 0.0 111.412 -179.672 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.753 HG23 ' HG ' ' A' ' 145' ' ' LEU . 14.1 p -148.74 162.72 5.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.493 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.02 137.97 34.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.897 0.38 . . . . 0.0 110.891 -179.832 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.65 173.09 6.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.748 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.669 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -142.21 134.4 27.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.931 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.876 ' CG ' HD13 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 39.65 -84.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.609 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 138' ' ' ALA . 10.7 t0 -144.33 41.08 1.35 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.815 0.34 . . . . 0.0 111.152 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.447 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . 10.8 m-85 -148.11 165.05 32.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.48 ' O ' HG13 ' A' ' 142' ' ' VAL . 14.6 p -115.51 121.11 66.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.669 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 51.0 m-85 -113.61 140.1 48.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.283 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 3.3 m80 -58.87 150.4 24.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.802 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.753 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.6 OUTLIER -61.74 -21.92 64.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.179 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.19 -49.14 6.54 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.598 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 63.9 m -57.04 -40.77 77.42 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.916 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.779 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.2 OUTLIER -56.85 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.119 -179.698 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.15 172.8 4.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.795 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.7 t -82.13 150.25 27.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.208 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 29.1 m -73.62 -31.89 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.304 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 20.5 t -99.46 -57.57 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.467 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.2 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.104 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? 60.0 44.5 13.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.95 139.63 52.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.622 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.9 mp0 -66.58 166.31 13.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.428 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.722 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.2 mm? -122.22 166.42 14.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.396 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 169.16 19.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.029 0.442 . . . . 0.0 111.472 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.434 HG23 ' N ' ' A' ' 12' ' ' GLU . 7.4 m -43.79 129.29 5.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.654 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 92.71 -21.36 39.37 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.882 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.45 ' OD1' HD12 ' A' ' 157' ' ' LEU . 6.9 t70 -73.91 130.96 40.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.835 0.35 . . . . 0.0 110.791 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.444 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 14.4 mt-10 -87.99 127.07 35.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.019 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.804 ' CD2' HD23 ' A' ' 171' ' ' LEU . 25.9 p90 -134.62 179.07 6.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.419 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.731 ' HB2' HG13 ' A' ' 172' ' ' VAL . 16.1 m-85 -133.08 115.04 14.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.333 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.876 HD13 ' CG ' ' A' ' 139' ' ' GLN . 5.9 tt -87.97 110.78 20.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 110.595 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 166' ' ' MET . . . . . 0.428 ' HE2' HG11 ' A' ' 172' ' ' VAL . 18.4 mmt -75.96 164.33 26.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.24 -28.13 62.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.171 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -97.38 28.92 3.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.54 33.96 23.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.987 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -98.39 98.55 9.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.804 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.5 OUTLIER -66.97 133.11 49.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.788 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.752 HG23 ' OD2' ' A' ' 176' ' ' ASP . 2.7 p -145.18 140.26 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.0 m -71.46 -178.43 2.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.965 0.412 . . . . 0.0 111.313 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.11 -31.15 22.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.885 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.57 25.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.451 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.752 ' OD2' HG23 ' A' ' 172' ' ' VAL . 8.1 p-10 -83.0 4.15 27.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.648 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.524 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 27.9 t80 -61.77 -66.14 0.58 Allowed 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.08 0.467 . . . . 0.0 110.966 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.03 -28.78 0.74 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.826 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -31.53 57.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.367 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.1 -31.74 12.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.514 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 64.42 174.28 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.868 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 ' N ' ' A' ' 8' ' ' MET . 13.2 p . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.869 0.366 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.485 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -145.08 179.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.605 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.467 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.7 p -155.03 135.38 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.358 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.453 HG23 ' CD1' ' A' ' 163' ' ' PHE . 43.9 t -60.42 146.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.45 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.473 ' C ' HG23 ' A' ' 159' ' ' THR . . . -130.14 -160.72 10.18 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.777 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 4.5 mm-40 -64.0 132.02 95.14 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.579 0.228 . . . . 0.0 110.832 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.555 ' HB2' HG12 ' A' ' 134' ' ' VAL . 21.9 Cg_exo -63.16 143.64 90.48 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.311 2.008 . . . . 0.0 112.337 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.13 155.01 11.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.372 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.915 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.1 OUTLIER -144.09 173.88 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.138 0.494 . . . . 0.0 111.697 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -68.38 0.24 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.144 -179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 85.49 63.32 1.57 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.268 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -109.45 -70.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.543 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.4 ' CA ' ' HB3' ' A' ' 131' ' ' PRO . 4.2 tt0 72.42 84.01 0.13 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.908 0.385 . . . . 0.0 110.793 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.483 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.4 OUTLIER -57.28 -167.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.926 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -177.51 179.69 48.08 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.581 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.635 ' HB3' HD22 ' A' ' 27' ' ' LEU . 11.6 m-20 -81.32 -30.03 34.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 110.955 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -58.26 -26.26 62.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -56.99 -68.56 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.076 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 6.5 mm-40 -103.42 176.02 5.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.939 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 121.8 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -95.65 162.08 13.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.804 HD11 ' C ' ' A' ' 99' ' ' GLU . 7.4 pt -62.84 158.28 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 m -123.8 106.95 10.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.827 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.04 101.86 6.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -144.68 162.22 37.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 6.3 mp0 -81.61 156.99 24.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.892 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -107.5 171.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.2 t -97.89 37.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.405 ' NE2' HG22 ' A' ' 70' ' ' ILE . 4.3 mp0 -127.02 163.09 24.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -169.76 -42.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -142.08 80.26 1.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.965 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.139 -179.993 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.682 0.277 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.99 168.73 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.546 2.164 . . . . 0.0 112.232 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 57.88 30.25 18.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.574 HD13 ' CG ' ' A' ' 69' ' ' HIS . 8.8 tt -105.01 136.65 19.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.975 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.71 125.88 20.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.351 2.034 . . . . 0.0 111.799 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.87 134.51 38.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.262 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.433 ' HB2' HG12 ' A' ' 70' ' ' ILE . 3.2 t -59.27 141.82 53.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.774 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -63.38 114.84 4.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.132 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.91 26.37 45.57 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.025 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -128.67 -178.88 4.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.798 0.333 . . . . 0.0 110.832 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -134.99 35.61 3.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.951 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.593 ' HG3' ' CE1' ' A' ' 69' ' ' HIS . 16.2 tt0 -151.7 -88.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.593 ' CE1' ' HG3' ' A' ' 68' ' ' GLN . 0.6 OUTLIER 175.75 -179.18 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.758 0.313 . . . . 0.0 110.958 179.908 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.45 HG13 ' CD2' ' A' ' 82' ' ' HIS . 3.2 mm -103.33 150.88 6.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.022 0.439 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.83 37.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.85 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -109.38 170.35 8.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.912 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -70.05 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.429 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -90.3 140.23 29.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.7 mm -141.56 151.24 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.16 106.96 17.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.496 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -90.83 115.48 27.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.978 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -152.71 167.03 30.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.794 HD21 ' SG ' ' A' ' 101' ' ' CYS . 1.6 mt 57.5 35.34 25.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 62.59 35.52 14.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.032 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -172.47 176.11 3.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.027 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.45 ' CD2' HG13 ' A' ' 70' ' ' ILE . 48.7 p-80 -95.43 117.95 31.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.706 ' NE1' HD12 ' A' ' 79' ' ' LEU . 61.5 m95 -110.72 125.79 53.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.731 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.93 175.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 t -80.01 -40.55 27.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.484 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -91.12 -19.71 22.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.27 17.65 9.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.306 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 83' ' ' TRP . 10.2 tp -127.93 73.59 1.47 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -127.26 150.49 49.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -60.48 126.42 27.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.799 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.4 m -58.48 -20.8 48.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.472 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -102.87 -63.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.765 0.317 . . . . 0.0 111.347 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.8 m -68.98 -30.18 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.25 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 57.87 22.35 8.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.028 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.9 m -87.23 152.21 52.45 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.177 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.93 118.97 5.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.24 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.58 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.3 mp -113.17 56.41 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.42 28.62 3.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.202 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.804 ' C ' HD11 ' A' ' 28' ' ' ILE . 3.4 mm-40 -135.09 -46.54 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.781 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.9 mtm180 -148.75 138.02 21.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.794 ' SG ' HD21 ' A' ' 79' ' ' LEU . 53.5 t -112.96 156.02 23.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.453 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -158.14 120.72 3.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.4 t -112.93 152.96 28.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.75 123.95 8.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.56 -104.99 1.32 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.443 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -67.72 0.89 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.788 0.327 . . . . 0.0 110.825 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.7 m -70.08 -176.97 1.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.5 p -110.57 116.0 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.096 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -113.86 120.9 42.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.447 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.4 p -63.98 173.99 1.66 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.847 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.453 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.06 -30.0 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 22.6 t0 -53.33 -58.01 8.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.312 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -71.93 -20.72 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.079 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.483 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 8.6 t80 -62.04 -27.22 68.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 2.3 m-85 -79.15 -44.56 21.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt -85.41 -62.39 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.466 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -58.16 -52.09 67.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.762 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 7.3 m-85 -88.46 -43.03 11.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.347 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.41 -159.9 17.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.416 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -103.09 142.92 33.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.786 0.327 . . . . 0.0 110.827 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 173.87 11.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.074 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.2 138.18 58.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.55 29.59 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.122 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.18 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.923 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 10.3 p -109.9 8.03 24.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.325 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 57.96 29.86 18.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.815 0.34 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.3 tp -87.55 143.82 27.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.787 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.65 103.69 1.24 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.698 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.608 ' CG2' HD11 ' A' ' 15' ' ' LEU . 53.8 mt -60.76 134.34 92.18 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.5 0.19 . . . . 0.0 110.489 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.515 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 80.4 Cg_exo -45.99 172.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.507 2.138 . . . . 0.0 112.54 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.4 ' HB3' ' CA ' ' A' ' 19' ' ' GLU . 7.3 Cg_exo -73.72 -55.37 0.09 OUTLIER 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.856 2.37 . . . . 0.0 113.393 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -126.14 22.05 7.31 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.617 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.915 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -53.57 -178.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.492 179.836 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.52 111.96 33.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.908 0.385 . . . . 0.0 111.123 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.713 HG23 ' HG ' ' A' ' 145' ' ' LEU . 7.1 p -157.09 164.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.952 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.505 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.59 138.18 34.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.493 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.72 130.08 52.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.785 -179.603 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.435 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.86 96.0 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 37.64 -88.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.1 m-20 -79.2 -34.27 43.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.789 -176.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.444 ' N ' ' CD1' ' A' ' 141' ' ' PHE . 1.3 m-85 -115.71 178.25 4.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 112.23 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 9.9 p -113.62 152.19 15.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.598 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -132.06 174.99 9.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.167 0.508 . . . . 0.0 111.561 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -81.48 166.63 20.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.014 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.713 ' HG ' HG23 ' A' ' 135' ' ' VAL . 3.6 mp -81.19 -33.42 33.01 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.32 -49.31 6.42 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.891 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 65.7 m -51.53 -35.06 38.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.201 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.642 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.92 117.97 4.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.221 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.34 -176.95 1.69 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.885 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.3 t -100.36 150.08 22.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.957 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 152' ' ' VAL . 8.4 m -69.33 -27.47 34.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 151' ' ' VAL . 21.4 t -104.99 -55.69 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.351 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.3 m -65.96 -27.92 68.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.979 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 17.9 tttt 58.04 31.94 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -123.97 144.18 49.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.015 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.525 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.0 mt-30 -61.92 162.41 9.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.322 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.705 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.4 mm? -113.99 165.22 12.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.47 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.404 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 168.75 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.489 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.473 HG23 ' C ' ' A' ' 11' ' ' GLY . 5.3 m -43.46 128.42 4.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.67 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.63 -25.35 23.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.681 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.467 ' C ' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -66.39 129.69 40.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.784 0.326 . . . . 0.0 110.758 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.45 ' HA ' HG23 ' A' ' 9' ' ' VAL . 20.9 mt-10 -87.89 124.17 33.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.877 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.1 p90 -140.18 147.72 40.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.012 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.694 ' HB2' HG13 ' A' ' 172' ' ' VAL . 36.8 m-85 -102.16 159.72 15.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.417 HD13 ' HE1' ' A' ' 8' ' ' MET . 1.1 tp -112.86 110.94 21.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.757 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 13.0 mmt -74.63 166.25 23.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.029 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -60.62 -26.96 67.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -96.95 27.93 3.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.073 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 57.46 40.02 27.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.068 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -104.03 141.54 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.877 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -93.3 130.86 38.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.694 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.1 p -145.06 123.68 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.073 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 26.4 m -56.51 -170.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.95 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -74.4 -57.68 3.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.55 82.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.073 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -65.46 -25.7 67.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.957 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 177' ' ' TYR . . . . . 0.456 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 9.5 t80 -54.67 -66.13 0.46 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.01 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.78 -32.83 73.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 57.7 m -67.4 -31.56 71.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -80.55 -51.96 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.104 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.35 -67.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 182' ' ' GLN . . . . . 0.451 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 5.3 mt-30 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.935 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.493 HG22 ' N ' ' A' ' 8' ' ' MET . 11.9 p . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.833 0.349 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.606 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -154.49 -178.17 6.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.524 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.8 p -155.05 136.29 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.004 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.448 HG21 ' HB3' ' A' ' 157' ' ' LEU . 30.1 t -52.88 146.3 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.903 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.742 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -140.86 -144.14 4.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.817 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 29.8 mt-10 -76.59 120.14 80.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.552 0.215 . . . . 0.0 110.808 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.918 ' HB2' HG12 ' A' ' 134' ' ' VAL . 20.7 Cg_exo -62.82 140.08 78.06 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.344 2.029 . . . . 0.0 112.127 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.36 164.55 34.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -138.0 173.44 11.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -29.18 68.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.809 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.14 87.31 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.619 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.33 124.3 1.18 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.569 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -107.08 22.78 15.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.709 0.29 . . . . 0.0 110.865 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 63.3 -179.9 0.15 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.38 133.04 6.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.532 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.488 ' HB3' HD22 ' A' ' 27' ' ' LEU . 65.5 m-20 -58.31 -30.53 66.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.836 0.35 . . . . 0.0 110.994 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -59.71 -28.64 67.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -58.52 -68.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.443 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 1.6 mm-40 -95.4 176.08 6.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.748 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -76.98 144.18 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.84 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.8 tp -112.01 165.14 12.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.931 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.949 HD12 HD21 ' A' ' 88' ' ' LEU . 35.5 mm -62.79 157.54 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.034 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.485 ' N ' HG22 ' A' ' 28' ' ' ILE . 3.6 m -124.75 106.95 10.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.924 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 101.88 12.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.546 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.578 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -139.71 149.62 43.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.945 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.21 145.31 37.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.493 ' O ' HG22 ' A' ' 34' ' ' THR . 2.0 m120 -108.91 -26.51 10.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.031 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 33' ' ' ASN . 15.0 t 45.31 36.0 2.09 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -113.78 34.69 4.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.825 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -59.58 -69.21 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -69.85 78.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.15 179.945 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.644 0.259 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.35 164.59 30.03 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.459 2.106 . . . . 0.0 112.187 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.88 30.63 20.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.749 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.437 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -104.76 135.3 19.32 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.067 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 14.8 Cg_endo -58.0 125.93 20.08 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.412 2.075 . . . . 0.0 112.035 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.17 138.67 31.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -57.43 164.19 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.869 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.469 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -84.29 114.61 21.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.377 179.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.16 -82.1 0.35 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.482 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.0 p -91.34 154.2 19.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 110.94 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -75.8 88.86 2.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -178.53 135.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.531 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.7 p-80 -72.23 145.28 48.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.01 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.457 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.5 mm -72.27 153.35 7.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.531 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -174.16 36.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -112.07 138.14 49.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.815 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -34.06 63.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.192 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -106.55 107.71 18.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.052 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.422 HG22 ' N ' ' A' ' 76' ' ' LEU . 47.9 mm -123.5 153.44 29.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.078 0.466 . . . . 0.0 111.258 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.422 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.0 mp -115.15 106.94 14.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.167 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 46.0 tttt -90.66 123.11 34.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.026 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.19 167.04 31.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.066 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.748 HD23 ' HD2' ' A' ' 26' ' ' ARG . 1.7 mt 57.29 34.12 24.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.125 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.84 34.3 14.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.79 171.98 5.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.058 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -89.72 117.94 28.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.852 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.71 ' NE1' HD12 ' A' ' 79' ' ' LEU . 47.4 m95 -111.44 126.08 54.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.848 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.53 143.66 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.931 179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.3 p -57.59 -37.58 73.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -91.08 -12.77 34.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.261 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 61.5 m -104.95 22.44 15.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.687 0.28 . . . . 0.0 111.152 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.949 HD21 HD12 ' A' ' 28' ' ' ILE . 18.2 tp -118.88 30.63 7.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.859 0.362 . . . . 0.0 110.864 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.6 153.27 20.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.871 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 5.4 t -59.33 147.02 37.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.74 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.77 -28.43 66.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.294 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -105.03 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 0.0 111.253 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.576 ' HB2' HG22 ' A' ' 95' ' ' VAL . 20.2 m -58.82 -29.44 66.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.166 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 57.77 21.8 7.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.134 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.576 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.8 m -90.46 156.61 45.44 Favored Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.166 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 118.94 5.77 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.443 2.095 . . . . 0.0 112.245 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.766 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.3 mp -101.29 72.27 1.42 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.5 30.6 3.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.084 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -146.6 -47.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.676 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.3 158.35 44.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.776 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.575 ' HB3' HD11 ' A' ' 28' ' ' ILE . 26.7 p -141.85 175.95 9.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.034 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' CE2' ' A' ' 114' ' ' PHE . 1.1 t80 -162.72 152.14 15.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.773 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -134.22 135.04 42.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HG3' ' CZ ' ' A' ' 118' ' ' PHE . 28.5 mmt-85 -147.95 124.0 10.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.31 1.6 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -166.29 -44.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 110.872 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.05 179.84 1.41 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.929 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.456 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.4 p -108.25 123.0 63.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.008 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.42 169.53 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.866 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' CYS . . . . . 0.766 ' HB3' HD21 ' A' ' 97' ' ' LEU . 21.0 p -121.85 168.21 12.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.634 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 8.6 mttp -78.14 -26.75 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -54.58 -49.77 69.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.265 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -83.94 -20.53 32.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 20' ' ' PHE . 9.0 t80 -61.41 -30.5 70.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.977 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.446 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.1 m-85 -69.19 -45.94 68.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.758 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -85.44 -60.77 1.93 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.594 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.27 -52.83 63.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.168 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 5.0 m-85 -84.29 -43.06 15.19 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -64.3 -136.96 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.514 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.5 m -103.06 153.97 19.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.732 0.301 . . . . 0.0 110.789 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.76 162.27 41.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.266 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.3 t -57.47 139.33 53.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.978 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.73 29.46 2.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.17 -58.15 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 15.1 p -107.67 10.37 29.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.358 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.22 36.24 27.12 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.783 0.325 . . . . 0.0 110.973 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 15.3 tp -99.73 137.4 38.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.939 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.99 131.74 36.52 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.658 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.7 HG22 HD11 ' A' ' 15' ' ' LEU . 12.0 mt -95.09 128.22 39.74 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.395 0.141 . . . . 0.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.628 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 82.4 Cg_exo -42.73 168.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.615 2.21 . . . . 0.0 112.614 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.419 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 23.2 Cg_exo -65.46 -55.36 0.46 Allowed 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.75 2.3 . . . . 0.0 113.843 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.859 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.52 21.49 7.8 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.21 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.664 HE21 HG23 ' A' ' 129' ' ' ILE . 1.1 pp0? -61.07 136.94 58.23 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.376 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.918 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -71.91 108.73 3.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.009 0.433 . . . . 0.0 111.054 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.0 p -144.83 159.33 14.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.906 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.489 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.79 136.22 37.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.03 164.31 12.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.033 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.642 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -106.41 96.71 6.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.667 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.438 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.92 -86.24 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.361 0.6 . . . . 0.0 111.746 -179.789 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.97 -49.18 4.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.789 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -84.25 161.26 20.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.597 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.2 p -103.89 152.21 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.553 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -128.54 175.13 8.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.129 0.49 . . . . 0.0 111.654 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.82 163.4 21.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.041 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -81.23 -31.71 33.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.734 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -49.28 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.789 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' CYS . . . . . 0.419 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 78.4 m -52.48 -32.35 39.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.991 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.718 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -57.05 119.82 6.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.034 -179.822 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.27 -177.04 1.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.975 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.9 t -101.47 150.09 23.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.03 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 152' ' ' VAL . 24.6 m -68.81 -26.87 33.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.335 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 151' ' ' VAL . 27.3 t -107.03 -56.41 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.25 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.1 m -65.88 -28.13 68.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.101 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.11 34.9 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -126.42 142.34 51.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.969 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.412 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.38 152.79 16.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.262 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.699 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.3 mm? -109.5 107.96 18.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' ALA . . . . . 0.424 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -91.3 168.06 11.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.475 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 159' ' ' THR . . . . . 0.742 HG23 ' HA2' ' A' ' 11' ' ' GLY . 6.9 m -40.73 132.33 2.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.83 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.07 -26.99 16.32 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.618 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.524 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.1 t0 -67.8 128.92 38.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.331 . . . . 0.0 110.84 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.473 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.3 mt-10 -87.99 114.5 24.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.825 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.805 ' CD2' HD23 ' A' ' 171' ' ' LEU . 11.5 p90 -128.16 143.62 51.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.015 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.517 ' HB2' HG13 ' A' ' 172' ' ' VAL . 11.1 m-85 -100.13 162.43 12.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.748 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.642 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -115.04 110.85 20.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.742 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.8 mmt -75.4 164.47 26.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.015 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -59.16 -26.26 64.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.129 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.71 27.09 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.099 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.0 46.76 18.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.922 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 0.1 OUTLIER -110.88 146.54 36.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.805 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -98.31 128.89 44.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.6 p -145.07 130.18 13.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 55.5 m -53.0 -179.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.108 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.413 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 0.5 OUTLIER -67.95 -61.03 2.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.32 72.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -63.58 -26.96 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.002 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -55.07 -66.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.007 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -53.99 -26.74 27.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.23 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.1 m -78.48 -30.16 47.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.976 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -93.74 -27.25 16.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.233 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm 63.28 173.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.885 -179.981 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.553 HG23 ' CE1' ' A' ' 164' ' ' TYR . 14.0 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.863 0.363 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.487 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.75 -175.09 3.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.636 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.401 HG23 ' HA ' ' A' ' 162' ' ' GLU . 4.2 p -154.39 150.8 11.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.156 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 161' ' ' ASP . 38.4 t -67.39 146.25 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.706 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.66 -162.03 10.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.388 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -71.5 145.37 90.14 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.568 0.223 . . . . 0.0 110.63 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.5 Cg_endo -83.02 130.0 5.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.58 163.73 37.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.395 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.564 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.7 OUTLIER -144.08 173.78 11.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.173 0.511 . . . . 0.0 111.621 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.534 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -38.27 87.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.428 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.745 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 64.24 81.54 0.11 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.65 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.72 -140.8 5.56 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.248 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 179.68 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.405 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 63.11 144.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.933 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 -160.45 8.9 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.534 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -83.98 -25.32 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.694 0.283 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -54.09 -26.64 28.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.245 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.43 -75.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.059 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 18.6 tp10 -101.79 163.5 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.867 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ptp85 -75.9 100.01 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.594 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.1 tp -63.33 165.21 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.808 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.0 pt -62.87 138.58 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.14 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.431 HG22 ' HG ' ' A' ' 31' ' ' LEU . 48.5 m -105.86 106.93 17.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HE ' HD11 ' A' ' 76' ' ' LEU . 1.1 tpt180 -78.34 101.69 7.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.394 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HG ' HG22 ' A' ' 29' ' ' THR . 0.3 OUTLIER -145.73 164.92 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.007 -179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.451 ' CG ' ' CE1' ' A' ' 74' ' ' PHE . 19.6 mt-10 -90.26 157.02 17.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -109.73 -29.41 8.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.53 ' O ' HG22 ' A' ' 34' ' ' THR . 22.5 m 62.18 31.41 17.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -115.86 71.71 0.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -105.39 31.29 5.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -158.53 79.78 0.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.927 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.733 0.302 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -51.71 165.82 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.463 2.109 . . . . 0.0 112.247 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.65 30.8 20.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.81 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.442 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.1 tp -108.91 134.92 20.2 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.442 ' HD2' HD12 ' A' ' 60' ' ' ILE . 26.2 Cg_endo -63.06 125.92 16.87 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.347 2.031 . . . . 0.0 112.163 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.75 147.36 26.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.2 t -59.01 154.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.905 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.501 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.86 114.81 21.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.575 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.7 -53.37 0.62 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.43 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 19.3 p -103.61 -178.99 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.767 0.318 . . . . 0.0 110.876 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.03 76.56 1.01 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.76 131.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.444 ' CD2' HD23 ' A' ' 71' ' ' LEU . 12.0 p-80 -63.97 148.14 50.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.437 ' HA ' HD13 ' A' ' 70' ' ' ILE . 5.7 mm -77.08 153.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.01 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.444 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.5 OUTLIER -172.64 35.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.832 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -104.88 179.11 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.86 -68.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.451 ' CE1' ' CG ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -80.99 115.96 20.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.441 HG22 ' N ' ' A' ' 76' ' ' LEU . 44.9 mm -123.2 154.93 29.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.301 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.441 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.59 107.59 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.264 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -90.77 122.44 33.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.063 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.78 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.88 158.29 30.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.173 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.63 HD22 ' OG ' ' A' ' 103' ' ' SER . 0.6 OUTLIER 58.19 37.46 26.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.157 179.862 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 61.67 35.71 16.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.074 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -174.39 169.98 3.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.863 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.4 p80 -89.33 125.31 35.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.961 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.658 ' CB ' HD13 ' A' ' 88' ' ' LEU . 58.6 m95 -113.65 125.36 54.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 171.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.063 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.05 -39.83 28.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -90.97 -28.26 18.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.988 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 79.1 m -71.96 -28.96 63.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.049 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.685 HD21 HG21 ' A' ' 28' ' ' ILE . 11.2 tp -79.59 82.83 5.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -137.63 150.59 47.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.4 t -64.25 130.06 42.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.789 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -23.49 52.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.491 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.13 -63.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.787 0.327 . . . . 0.0 111.226 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.449 ' HB2' HG22 ' A' ' 95' ' ' VAL . 34.0 m -66.54 -33.07 74.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.172 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 57.08 22.63 7.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.051 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.499 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.9 m -87.85 152.15 50.81 Favored Pre-proline 0 N--CA 1.453 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.227 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -57.24 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.504 2.136 . . . . 0.0 112.169 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.645 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.2 mp -108.86 64.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.746 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.97 29.42 3.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.808 ' C ' HD11 ' A' ' 28' ' ' ILE . 23.0 mm-40 -135.11 -46.51 0.71 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.594 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.05 173.48 11.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.692 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.5 t -156.94 156.04 32.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.017 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PHE . . . . . 0.472 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -155.96 136.09 12.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.746 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 2.0 p -151.03 174.12 13.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.009 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -177.2 123.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.29 -95.55 1.86 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.535 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -142.19 38.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.906 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' SER . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 0.7 OUTLIER -152.65 177.96 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.3 p -149.13 115.99 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.187 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 107' ' ' SER . 0.4 OUTLIER -122.15 159.89 26.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.2 p -71.53 160.22 33.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.656 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 ttmt -56.94 -45.12 82.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.074 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.438 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 30.1 t70 -58.91 -29.5 67.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.107 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -84.1 -26.07 29.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.318 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 36.7 t80 -66.8 -39.06 87.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 112' ' ' ASP . 7.5 m-85 -65.38 -39.51 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.1 tttp -84.13 -30.12 26.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.119 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.9 mmm-85 -82.09 -53.79 5.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.192 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.25 -42.99 11.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.5 167.7 53.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.419 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 33.0 m -58.5 150.27 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.756 0.312 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -145.49 163.31 35.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.051 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HB2' HD11 ' A' ' 129' ' ' ILE . 48.6 t -72.8 130.7 41.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.88 28.01 4.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.106 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -54.62 1.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 26.8 p -111.08 -22.61 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 69.67 69.81 0.24 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.11 -166.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.792 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -103.5 86.95 0.55 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.557 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.752 HG23 HE21 ' A' ' 133' ' ' GLN . 16.3 mt -65.94 126.28 91.53 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.455 0.169 . . . . 0.0 110.833 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.592 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.4 Cg_exo -51.49 -178.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.233 1.955 . . . . 0.0 111.959 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 64.9 Cg_endo -77.24 -53.25 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.298 1.998 . . . . 0.0 113.901 -179.126 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.745 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.94 21.83 9.77 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLN . . . . . 0.785 ' OE1' HD11 ' A' ' 145' ' ' LEU . 1.0 OUTLIER -55.49 145.33 23.14 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.365 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.898 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -87.79 108.9 18.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.963 0.411 . . . . 0.0 110.862 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 135' ' ' VAL . . . . . 0.69 HG23 ' HG ' ' A' ' 145' ' ' LEU . 11.4 p -150.5 159.82 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.078 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ARG . . . . . 0.507 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 137.55 35.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.83 130.67 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.975 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -70.71 96.65 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.748 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.449 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 55.31 -86.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.386 0.612 . . . . 0.0 111.797 -179.773 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.414 ' OD2' ' CZ ' ' A' ' 141' ' ' PHE . 5.5 p-10 -99.6 -47.56 5.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.723 -178.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.676 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.5 m-85 -79.26 163.24 25.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.95 133.05 61.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' TYR . . . . . 0.628 ' O ' HG21 ' A' ' 135' ' ' VAL . 5.0 m-85 -111.06 171.45 7.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.05 0.452 . . . . 0.0 111.344 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 41.1 m80 -99.52 140.01 34.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.844 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.898 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.73 -20.07 45.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.471 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.01 -36.49 14.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.266 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 14.27 32.39 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.871 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 42.5 t80 -104.05 102.31 12.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.71 0.29 . . . . 0.0 110.657 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -156.86 -176.92 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.26 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -92.23 150.04 21.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 152' ' ' VAL . 16.8 m -65.59 -26.7 39.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.315 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -104.43 -56.28 5.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.345 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 20.3 m -65.91 -28.12 68.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.074 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 30.0 7.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.13 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -119.14 153.05 35.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' GLN . . . . . 0.424 ' C ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -68.24 154.08 42.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.708 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -115.9 137.46 52.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -109.34 161.28 15.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.039 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.7 t -46.23 130.28 10.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.372 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 109.34 -34.36 5.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.591 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' ' 10' ' ' VAL . 2.2 t0 -65.17 130.29 42.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.722 0.296 . . . . 0.0 110.784 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 48.8 mt-10 -87.96 119.65 28.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' PHE . . . . . 0.547 ' CD2' HD23 ' A' ' 171' ' ' LEU . 5.7 p90 -134.01 147.57 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' TYR . . . . . 0.553 ' CE1' HG23 ' A' ' 7' ' ' VAL . 30.9 m-85 -100.59 147.3 26.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.673 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 165' ' ' LEU . . . . . 0.547 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -105.41 114.19 28.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.5 mmt -69.39 174.49 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -66.81 -29.08 68.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.028 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -97.74 29.8 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.028 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.86 33.95 23.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.949 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' ARG . . . . . 0.503 ' HG2' HG11 ' A' ' 151' ' ' VAL . 1.4 tpt180 -88.57 132.73 34.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' LEU . . . . . 0.871 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -84.94 121.01 27.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 172' ' ' VAL . . . . . 0.539 HG23 ' HB3' ' A' ' 176' ' ' ASP . 14.6 p -145.02 121.56 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.124 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 56.1 m -54.88 -174.37 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.856 0.36 . . . . 0.0 111.084 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -69.44 -60.94 2.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.15 -38.96 84.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.021 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ASP . . . . . 0.539 ' HB3' HG23 ' A' ' 172' ' ' VAL . 13.1 m-20 -59.25 -24.77 63.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -54.77 -63.72 1.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -49.18 -27.9 3.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.304 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 -25.33 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.95 -20.55 20.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.518 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.48 -177.58 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.836 0.351 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.736 0.303 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.2 t -104.45 84.52 2.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.31 113.79 27.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.2 m -60.1 150.16 71.77 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -167.77 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.467 2.111 . . . . 0.0 112.328 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -64.8 80.15 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.895 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 8' ' ' MET . 13.5 p -124.2 158.75 30.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.154 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.49 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.74 -179.96 6.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.682 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.5 p -155.06 137.0 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.115 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.413 HG21 ' CB ' ' A' ' 157' ' ' LEU . 48.1 t -57.88 146.14 8.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.565 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.681 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -133.62 -151.11 6.44 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.782 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -71.8 122.57 87.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.446 0.165 . . . . 0.0 110.954 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.0 Cg_exo -64.44 142.92 80.62 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.328 2.019 . . . . 0.0 112.149 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.04 158.43 14.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.851 HD11 HG22 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -129.2 173.31 10.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.155 0.502 . . . . 0.0 111.267 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -37.84 81.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.932 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.754 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.01 79.62 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.552 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -145.55 -55.35 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 64.19 29.48 13.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.729 0.299 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 58.93 -168.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.973 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -148.99 125.3 2.0 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -59.9 -31.53 69.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.51 -30.23 70.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.46 -74.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 5.7 tp10 -78.2 151.35 33.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.977 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -76.08 101.96 5.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.875 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 100' ' ' ARG . 1.7 tp -73.92 165.13 25.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.784 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 6.0 pt -62.86 137.61 24.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -104.34 106.89 17.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD2' HD12 ' A' ' 28' ' ' ILE . 0.0 OUTLIER -83.1 101.77 11.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.469 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.576 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.4 157.31 44.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.001 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.08 116.88 18.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.6 163.71 23.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.5 t -107.4 31.57 5.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -104.1 37.63 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -98.69 31.49 2.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.911 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -167.31 33.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.844 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -129.37 137.53 51.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.145 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 59.95 -179.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.163 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -88.1 79.61 7.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.892 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.3 -63.05 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.514 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.5 140.4 11.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.65 146.42 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.855 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 60.55 158.33 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -100.79 85.21 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.875 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.43 -169.35 26.77 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.492 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.86 99.43 0.66 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.494 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 t 60.59 110.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.821 0.343 . . . . 0.0 110.858 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.5 -46.62 1.22 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.9 -103.0 2.52 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.553 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -96.59 114.35 25.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.918 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 6.4 mtp -106.07 -178.66 3.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.97 117.84 1.23 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.505 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -158.82 102.19 1.66 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.854 0.359 . . . . 0.0 110.93 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -98.67 -142.01 12.88 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.439 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.03 148.64 42.7 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.459 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.0 84.95 58.97 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.684 0.278 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.74 167.15 23.8 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.468 2.112 . . . . 0.0 112.211 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 57.9 30.01 18.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.762 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.488 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -104.5 135.38 19.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.046 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.69 125.89 18.4 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.412 2.074 . . . . 0.0 112.069 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.404 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -92.48 148.76 21.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.109 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.36 138.11 56.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.735 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -61.6 114.85 3.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.269 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.92 28.29 42.5 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.069 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.12 -178.92 5.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.883 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -106.73 -28.93 9.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.76 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -166.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.821 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.488 ' CD2' HG21 ' A' ' 60' ' ' ILE . 5.1 p80 -107.53 161.51 14.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.02 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 70' ' ' ILE . 6.9 mm -74.83 153.66 6.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.053 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -163.46 30.84 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.919 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -107.2 -178.99 3.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -84.46 -74.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -75.74 125.59 29.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 76' ' ' LEU . 46.6 mm -134.27 148.2 29.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.123 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.3 mp -105.38 106.97 17.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.465 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -90.93 114.98 27.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.784 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -148.94 163.47 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.115 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.739 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER 55.45 35.59 25.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.07 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 62.36 40.75 10.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -176.99 166.5 2.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.013 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -88.88 117.97 28.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.739 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 65.1 m95 -111.77 126.0 54.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.844 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.434 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -51.57 175.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.171 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -80.03 -40.69 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.283 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -91.08 -16.48 27.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.128 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -96.4 26.1 4.58 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.597 HD21 HG21 ' A' ' 28' ' ' ILE . 1.7 tp -128.62 29.24 5.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.996 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.38 150.26 21.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 4.3 t -60.46 125.25 22.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.816 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.29 -22.51 61.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.289 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -99.69 -63.08 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.735 0.302 . . . . 0.0 111.206 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.511 ' HB2' HG22 ' A' ' 95' ' ' VAL . 32.0 m -66.76 -32.31 73.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 59.07 23.35 11.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.102 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.511 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.1 m -90.82 149.34 40.17 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.153 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.82 118.95 5.8 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.561 2.174 . . . . 0.0 112.248 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.547 HD21 ' HB3' ' A' ' 110' ' ' CYS . 7.9 mp -111.04 63.05 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.78 39.49 1.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.188 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.754 ' C ' HD11 ' A' ' 28' ' ' ILE . 9.4 mt-10 -148.25 -49.18 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.587 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -136.52 174.2 10.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.628 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.8 t -156.98 156.15 32.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.504 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.7 OUTLIER -150.13 154.63 38.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 60.1 p -132.29 144.76 50.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.993 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.64 139.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.6 40.11 95.96 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.569 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 59.6 31.22 20.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -148.99 145.15 27.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.1 p -87.22 115.97 28.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.127 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.68 170.52 8.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.826 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.547 ' HB3' HD21 ' A' ' 97' ' ' LEU . 29.5 p -99.56 169.04 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.83 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 4.5 tttp -78.13 -29.79 49.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.267 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -53.42 -58.02 8.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.469 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.5 p30 -74.16 -20.94 60.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.314 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 13.5 t80 -63.65 -30.95 71.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.75 0.31 . . . . 0.0 110.926 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 5.1 m-85 -79.12 -39.21 34.21 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -85.07 -64.04 1.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.335 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -64.79 -48.62 73.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.64 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -102.01 36.89 1.98 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.332 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.94 -146.61 4.44 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.594 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.0 m -94.79 152.35 18.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 110.977 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.419 ' HZ3' ' HA ' ' A' ' 123' ' ' ALA . 0.0 OUTLIER -164.45 170.37 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.5 t -64.11 141.34 58.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.419 ' HA ' ' HZ3' ' A' ' 121' ' ' LYS . . . -94.74 27.14 3.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.121 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.24 -58.08 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.9 p -108.27 5.4 25.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.414 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 59.38 29.47 19.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.14 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.85 151.95 25.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.742 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -81.13 107.79 2.75 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.698 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.851 HG22 HD11 ' A' ' 15' ' ' LEU . 12.1 mt -70.41 130.92 88.7 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 110.52 -0.178 . . . . 0.0 110.52 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.643 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.5 Cg_exo -47.52 175.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.361 2.041 . . . . 0.0 112.23 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.7 Cg_endo -77.2 -49.91 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.471 2.114 . . . . 0.0 113.799 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.754 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -126.06 21.7 7.41 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.34 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.643 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -57.0 -168.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.68 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.777 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -123.59 108.9 21.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.936 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.697 ' HB ' HD11 ' A' ' 145' ' ' LEU . 12.4 p -152.67 158.87 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.065 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.481 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.86 135.92 38.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.793 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.93 135.0 47.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.975 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.619 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.31 96.57 2.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.939 0.399 . . . . 0.0 110.618 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.51 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.75 -86.33 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.4 -48.19 4.88 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.873 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -83.95 162.58 20.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.715 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.3 150.9 7.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.593 ' O ' HG21 ' A' ' 135' ' ' VAL . 23.0 m-85 -133.26 175.08 9.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.452 . . . . 0.0 111.37 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.31 161.84 22.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.046 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.777 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.6 mp -81.08 -30.2 34.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.149 0.5 . . . . 0.0 109.678 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -91.2 -49.26 6.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.665 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.7 m -53.87 -31.26 49.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.9 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.764 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.91 121.1 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.091 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.24 -177.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -100.92 150.14 23.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 152' ' ' VAL . 16.7 m -64.73 -26.87 41.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.263 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 151' ' ' VAL . 21.2 t -109.53 -55.9 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.338 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 m -65.86 -28.11 68.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.012 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 30.87 17.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.986 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -119.02 139.97 50.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.951 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.447 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.11 154.29 13.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.26 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.731 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.7 OUTLIER -116.57 107.32 14.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.538 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -90.17 172.28 8.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.681 HG23 ' HA2' ' A' ' 11' ' ' GLY . 7.9 m -43.01 132.29 4.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.734 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.35 -27.86 13.97 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.664 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.591 ' OD2' HD12 ' A' ' 157' ' ' LEU . 5.4 t0 -67.0 128.84 37.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.802 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.452 ' HA ' HG23 ' A' ' 9' ' ' VAL . 9.2 mt-10 -88.04 122.21 31.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.709 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -138.45 146.75 42.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.691 ' HB2' HG13 ' A' ' 172' ' ' VAL . 48.1 m-85 -101.58 151.47 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.619 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -107.65 110.96 22.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.797 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.5 mtp -69.4 161.23 29.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -62.7 -28.57 70.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.074 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -97.76 29.11 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.019 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.14 83.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.978 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.422 ' HE ' HG11 ' A' ' 151' ' ' VAL . 8.1 mtp180 -154.92 131.66 10.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.764 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 4.4 mp -83.62 128.21 34.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.691 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.4 p -145.11 122.45 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.082 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 20.4 m -58.38 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.412 ' HZ1' ' CD ' ' A' ' 162' ' ' GLU . 21.6 mttt -75.52 -57.05 4.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.84 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -33.6 70.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.108 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -72.98 -28.91 62.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -56.84 -66.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.946 0.403 . . . . 0.0 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.31 -49.73 75.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.942 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 67.5 m -59.43 -26.3 65.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.964 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -79.08 -51.98 8.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.252 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.74 -66.57 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.098 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.203 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.798 0.332 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -87.86 156.46 19.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.15 110.22 1.54 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.856 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.788 HG21 HG12 ' A' ' 7' ' ' VAL . 15.4 m -148.2 149.0 31.07 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.098 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.94 -45.8 0.88 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.529 2.153 . . . . 0.0 112.346 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -170.07 90.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.788 HG12 HG21 ' A' ' 4' ' ' VAL . 12.6 p -117.61 158.57 18.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.152 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.484 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.45 -173.64 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.595 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.3 p -151.82 147.69 15.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 161' ' ' ASP . 43.9 t -66.95 146.23 13.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.628 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.32 -157.9 9.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.572 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 0.0 OUTLIER -76.31 151.29 83.35 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.665 0.269 . . . . 0.0 110.815 -179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.777 ' HB2' HG12 ' A' ' 134' ' ' VAL . 2.6 Cg_endo -83.0 143.47 11.54 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.874 2.383 . . . . 0.0 112.417 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.57 142.92 8.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.344 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.559 HD21 ' CG1' ' A' ' 135' ' ' VAL . 7.7 mt -127.04 173.54 9.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 111.293 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.408 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -49.51 -50.49 41.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.793 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.583 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 62.69 80.82 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.457 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -160.27 -48.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.368 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 59.56 46.33 12.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 110.923 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE1' ' CD1' ' A' ' 115' ' ' PHE . 14.0 p90 -59.17 -179.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.929 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -173.54 -132.41 1.53 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.567 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.706 ' CB ' HD13 ' A' ' 27' ' ' LEU . 4.3 p-10 -55.21 -28.42 52.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.736 0.303 . . . . 0.0 111.16 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.35 -25.99 60.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.201 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.89 -70.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.073 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.3 tp10 -101.62 175.11 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 100.68 4.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 22' ' ' ASP . 2.9 tp -63.15 165.11 7.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.763 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.3 pt -62.9 148.49 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.5 m -107.74 106.78 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.82 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.19 101.82 9.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.435 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.86 154.02 40.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -78.63 157.05 28.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -110.6 102.31 10.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 41.3 p -60.18 86.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -150.32 -76.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 57.68 28.58 16.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.025 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -176.67 78.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.902 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.28 42.34 3.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 63.19 124.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.143 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.7 t30 60.83 35.78 19.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -95.8 -83.54 1.65 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.479 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.497 HG23 ' N ' ' A' ' 43' ' ' ASP . 4.7 tp -52.34 -44.97 44.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.834 0.35 . . . . 0.0 111.515 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' HG23 ' A' ' 42' ' ' ILE . 64.7 m-20 -107.73 142.5 37.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -83.41 164.65 19.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -71.67 151.4 43.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -161.35 93.44 0.12 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.491 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.37 -38.16 3.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.528 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -174.59 -41.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.15 -36.51 1.91 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -81.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.492 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -170.35 35.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.807 0.337 . . . . 0.0 110.883 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.3 mtt -96.02 161.05 14.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.66 160.55 8.95 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.5 p -69.02 -74.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.859 0.361 . . . . 0.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.13 42.29 0.26 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.47 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.31 -160.65 54.09 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.572 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.581 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER -87.49 140.9 31.98 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.617 0.246 . . . . 0.0 110.88 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 57' ' ' THR . 63.1 Cg_endo -73.43 163.96 36.34 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.49 2.127 . . . . 0.0 112.226 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 56.98 29.07 15.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.522 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.4 tp -99.1 134.89 21.02 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.077 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.2 Cg_endo -58.46 125.96 19.95 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.458 2.105 . . . . 0.0 112.097 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.19 140.12 29.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.057 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.3 p -58.36 164.22 2.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.93 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.437 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.98 114.59 24.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.445 179.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 125.09 -66.46 0.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.56 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -109.83 155.34 21.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.858 0.361 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -75.39 87.53 2.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.143 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.47 134.44 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.522 ' ND1' HG21 ' A' ' 60' ' ' ILE . 16.3 p-80 -72.77 141.05 48.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.478 ' HA ' HD13 ' A' ' 70' ' ' ILE . 5.6 mm -67.52 153.65 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.498 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.5 OUTLIER -172.55 35.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.864 -179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.82 145.83 38.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.179 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.0 110.84 18.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.853 0.359 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 76' ' ' LEU . 42.0 mm -121.67 153.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.211 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 75' ' ' ILE . 7.8 mp -109.61 106.75 16.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.305 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -91.03 116.36 28.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.964 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.763 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -157.13 165.63 35.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.163 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.805 HD12 ' NE1' ' A' ' 83' ' ' TRP . 3.0 mt 59.09 36.43 24.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.072 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 62.3 34.42 15.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.023 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -176.45 178.57 1.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.917 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -94.41 126.85 39.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.913 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.805 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.7 m95 -116.86 132.73 56.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.08 171.55 0.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.07 -40.21 28.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.089 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 pttp -90.95 -28.18 18.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.127 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 57.7 m -67.6 -30.62 70.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 83' ' ' TRP . 1.6 tp -81.12 94.12 6.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -155.35 154.53 32.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.933 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 147.03 38.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.7 t -72.78 -31.27 64.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.916 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -97.28 -59.97 1.68 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.977 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 45.7 m -60.02 -34.47 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 57.37 22.46 7.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.056 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -84.63 156.65 61.74 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.048 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.9 118.9 5.94 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.522 2.148 . . . . 0.0 112.246 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.583 HD23 ' SG ' ' A' ' 101' ' ' CYS . 7.4 mp -103.24 71.03 1.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -106.07 30.91 5.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -148.55 -49.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.617 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -142.99 128.99 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.583 ' SG ' HD23 ' A' ' 97' ' ' LEU . 1.5 t -123.83 171.09 9.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.6 m-85 -156.32 151.5 26.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.518 ' OG ' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -151.65 140.05 20.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -150.01 123.97 9.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.23 -88.64 1.59 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.506 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.02 35.86 0.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.447 ' HB2' ' CE1' ' A' ' 109' ' ' TYR . 48.9 m -150.73 -175.02 4.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 102' ' ' PHE . 11.7 p -136.97 116.0 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.082 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 107' ' ' SER . 1.3 m-85 -116.69 173.24 6.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.9 p -89.13 178.31 6.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 12.3 ttmt -73.65 -48.97 28.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.91 -30.55 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.218 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -84.04 -21.64 31.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.319 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 12.9 t80 -69.52 -41.17 76.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 6.6 m-85 -66.78 -36.8 83.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.921 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.36 -44.4 13.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.25 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -78.94 -50.92 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.244 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -108.67 37.02 2.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.59 165.25 33.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.444 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.795 HG22 HG11 ' A' ' 142' ' ' VAL . 1.6 m -57.85 151.08 18.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.757 0.313 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -163.3 159.43 22.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.167 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 124' ' ' ALA . 43.3 t -74.2 135.76 42.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.787 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.66 34.21 1.9 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 122' ' ' CYS . . . -125.12 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.096 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.5 p -109.9 12.54 23.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.411 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.7 mp0 55.5 30.84 15.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.754 0.311 . . . . 0.0 111.04 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -103.49 130.49 50.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.96 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.98 131.19 51.93 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.444 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.585 HG23 ' HD2' ' A' ' 130' ' ' PRO . 51.9 mt -79.25 140.06 56.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.922 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.589 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 92.7 Cg_exo -44.83 171.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.833 2.355 . . . . 0.0 112.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -77.37 -55.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.588 2.192 . . . . 0.0 114.807 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.583 HG23 ' CA ' ' A' ' 17' ' ' GLY . 1.6 m -126.55 21.46 7.13 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.589 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 82.9 mm-40 -61.42 -176.04 0.07 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.777 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.65 116.49 49.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.973 0.416 . . . . 0.0 111.167 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.559 ' CG1' HD21 ' A' ' 15' ' ' LEU . 8.8 p -157.06 162.96 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.538 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.22 142.17 28.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.016 0.436 . . . . 0.0 110.857 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.427 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.6 OUTLIER -116.05 123.64 48.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.836 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.517 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -57.43 96.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.077 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.439 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 52.98 -87.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.223 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 138' ' ' ALA . 6.5 t0 -96.64 -47.13 6.03 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.988 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.88 157.31 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.083 0.468 . . . . 0.0 111.746 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.795 HG11 HG22 ' A' ' 120' ' ' THR . 7.6 p -107.68 149.51 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.621 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -131.92 163.24 28.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.008 0.432 . . . . 0.0 111.403 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -63.59 165.38 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.964 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.64 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.2 mp -81.03 -32.76 33.99 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -91.34 -49.26 6.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.903 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.425 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 80.8 m -50.44 -38.93 46.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.795 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.5 t80 -56.91 118.38 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.233 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.09 179.24 2.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.048 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -85.33 150.09 25.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.971 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 152' ' ' VAL . 8.2 m -72.17 -34.64 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.144 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -102.95 -51.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 14.0 m -66.02 -28.05 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.982 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm 57.79 40.71 25.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.132 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -128.96 143.16 50.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.972 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.701 ' C ' HD22 ' A' ' 157' ' ' LEU . 13.9 mp0 -61.35 172.36 1.15 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.954 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 156' ' ' GLN . 1.8 mm? -127.45 164.62 21.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 158.91 43.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.4 t -43.01 129.46 4.44 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.619 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.75 -27.95 16.85 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.553 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.545 ' O ' HG23 ' A' ' 10' ' ' VAL . 30.1 m-20 -70.27 129.13 38.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.772 0.32 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -89.31 114.92 26.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.972 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.2 p90 -129.64 152.05 49.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 23.0 m-85 -101.48 139.31 37.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.739 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.517 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -99.94 127.09 46.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.707 179.793 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.4 mmt -90.66 161.92 15.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.039 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -23.6 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -96.05 27.45 3.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.093 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.06 30.09 15.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.099 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 154.52 19.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.862 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.795 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -109.25 121.73 45.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.024 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.456 HG13 ' O ' ' A' ' 172' ' ' VAL . 7.6 p -145.08 121.67 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.002 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 21.7 p -76.07 -169.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -43.39 54.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.283 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.05 -52.25 61.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.6 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -84.98 4.06 35.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.64 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.0 t80 -67.53 -66.11 0.6 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.881 0.372 . . . . 0.0 110.83 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.13 -23.53 65.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 75.2 m -84.64 -32.75 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.046 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -89.91 -29.66 18.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.284 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 61.79 175.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.7 p . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.792 0.33 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -130.44 126.25 36.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -153.27 82.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.5 HG12 HG11 ' A' ' 7' ' ' VAL . 12.7 m -106.96 82.69 1.14 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.16 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.59 -45.64 1.09 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.574 2.182 . . . . 0.0 112.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -159.3 38.86 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.617 HG23 ' CE1' ' A' ' 164' ' ' TYR . 12.5 p -72.85 158.43 6.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.12 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.66 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.11 178.73 6.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.663 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' A' ' 162' ' ' GLU . 9.4 p -154.96 135.39 4.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.248 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' CD1' ' A' ' 163' ' ' PHE . 61.4 t -53.54 146.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.592 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.585 ' C ' HG23 ' A' ' 159' ' ' THR . . . -139.35 -148.63 5.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.657 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 13' ' ' PRO . 25.3 mt-10 -72.98 115.28 38.74 Favored Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 122.906 -0.173 . . . . 0.0 110.73 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.558 ' O ' HG12 ' A' ' 134' ' ' VAL . 27.2 Cg_endo -62.3 135.41 53.91 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.251 1.967 . . . . 0.0 112.213 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.23 167.9 27.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.42 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 129' ' ' ILE . 1.4 mt -143.99 173.91 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.226 0.536 . . . . 0.0 111.746 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.427 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.96 -35.99 71.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.501 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.824 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.99 94.78 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.589 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.43 103.33 0.31 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.298 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 16.5 mt-10 -50.91 -71.71 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 111.069 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' HB2' ' CE1' ' A' ' 115' ' ' PHE . 29.0 t80 -176.94 -66.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.91 120.97 1.41 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.489 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.95 -44.22 14.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -29.69 68.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.79 -31.34 68.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.962 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 6.6 tp10 -109.23 160.68 15.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.933 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.29 101.92 5.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.901 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.643 HD11 ' HB3' ' A' ' 100' ' ' ARG . 0.7 OUTLIER -76.89 164.95 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.85 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.795 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.8 pt -62.95 147.88 11.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.22 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -114.88 106.91 14.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.757 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.77 101.83 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.626 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -145.65 146.86 31.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.947 -179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -75.4 147.75 39.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -104.87 160.14 15.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.6 t -98.7 32.56 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -105.63 78.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -94.23 -33.32 13.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.912 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -131.86 82.23 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.66 82.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.079 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 63.09 18.09 10.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.506 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -173.77 -64.67 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.879 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 64.3 -81.01 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.508 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.528 HG23 ' O ' ' A' ' 42' ' ' ILE . 10.6 tp -54.62 119.15 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.315 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.63 -42.14 22.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.816 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.24 90.04 7.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.94 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -103.99 116.85 32.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.953 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.88 -146.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.549 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.42 62.41 0.49 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.518 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 m -99.39 152.8 19.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 0.0 110.86 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 165.95 -141.63 7.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.56 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 151.84 -84.92 0.15 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.458 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 45.3 m-70 -104.39 -49.48 3.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.1 ttt -164.91 114.84 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.924 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.93 148.01 42.35 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.5 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.41 131.98 40.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.912 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -176.09 122.62 0.87 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.526 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 136.44 95.89 0.44 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.471 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.7 85.2 2.26 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.665 0.269 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.12 164.57 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.542 2.161 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 59.5 30.81 20.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.925 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.517 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.6 tp -103.81 134.75 19.56 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.034 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.455 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.3 Cg_endo -58.72 125.93 19.73 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.415 2.077 . . . . 0.0 112.056 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.33 138.51 31.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.13 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.565 ' HA ' ' CE1' ' A' ' 82' ' ' HIS . 13.8 p -57.98 164.27 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.86 114.66 24.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.501 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.59 -71.1 0.45 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.527 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 13.6 p -103.59 153.07 21.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.826 0.346 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -74.03 87.04 1.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -179.05 137.74 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' HD23 ' A' ' 71' ' ' LEU . 15.9 p-80 -76.53 145.8 38.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -73.53 153.76 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.535 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -172.94 35.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.961 -179.89 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.425 ' HB2' HD11 ' A' ' 75' ' ' ILE . 3.9 m-20 -110.59 159.61 17.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -60.11 -75.25 0.06 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -74.86 112.12 10.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.444 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.3 mm -120.93 152.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.226 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.9 mp -111.79 106.78 15.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -90.81 128.01 36.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.795 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -161.48 158.95 27.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.261 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.677 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.6 OUTLIER 59.57 38.45 22.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.09 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 61.43 29.32 18.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -173.9 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.866 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.565 ' CE1' ' HA ' ' A' ' 63' ' ' CYS . 34.9 p80 -105.34 124.31 49.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.677 ' NE1' HD12 ' A' ' 79' ' ' LEU . 49.3 m95 -112.37 130.77 55.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.714 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.569 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.14 171.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.1 -39.98 28.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.003 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -91.03 -29.79 17.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 74.6 m -67.13 -30.73 70.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.957 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.464 ' CD2' HG21 ' A' ' 28' ' ' ILE . 1.6 tp -69.5 90.61 0.55 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -148.42 148.27 30.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.846 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.8 t -58.13 147.04 31.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 t -74.75 -29.1 61.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.252 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.847 0.356 . . . . 0.0 111.16 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.437 ' HB2' HG22 ' A' ' 95' ' ' VAL . 15.9 m -61.7 -32.57 72.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.053 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 54.15 24.73 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.129 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.437 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -83.9 146.7 49.67 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.138 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.63 118.99 5.69 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.533 2.155 . . . . 0.0 112.268 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -114.32 108.66 17.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.88 30.99 2.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.174 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.743 ' C ' HD11 ' A' ' 28' ' ' ILE . 12.0 mt-10 -139.78 -47.08 0.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.643 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -134.43 174.21 10.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.762 ' HB2' HG23 ' A' ' 28' ' ' ILE . 48.0 t -157.0 127.98 6.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.948 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 50.2 t80 -129.93 120.64 25.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.482 ' OG ' HD22 ' A' ' 79' ' ' LEU . 93.2 p -138.0 156.1 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.5 mtt85 -154.03 124.43 7.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.931 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.18 -54.15 4.22 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.532 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -176.33 -42.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.331 . . . . 0.0 110.88 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -78.73 151.29 32.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.832 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 108' ' ' VAL . 13.0 p -114.12 122.75 68.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.049 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.467 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -145.54 133.08 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 17.9 p -55.59 148.38 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 1.8 mtmp? -64.09 -19.98 65.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 t0 -46.62 -58.07 4.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.818 0.342 . . . . 0.0 111.323 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -77.68 -20.62 53.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.075 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.505 ' CZ ' ' CD2' ' A' ' 118' ' ' PHE . 11.1 t80 -58.16 -27.89 64.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.899 0.381 . . . . 0.0 110.695 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 1.9 m-85 -73.04 -28.77 62.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -82.31 -31.8 29.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.503 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.438 ' HD3' ' CE2' ' A' ' 118' ' ' PHE . 9.1 ptp180 -88.57 -37.25 15.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.443 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.505 ' CD2' ' CZ ' ' A' ' 114' ' ' PHE . 93.9 m-85 -103.36 -43.11 5.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.888 0.375 . . . . 0.0 111.151 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -70.31 170.83 44.37 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.468 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 71.5 m -58.65 152.36 18.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 110.805 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -138.65 172.33 13.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.037 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.499 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -85.27 129.61 34.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.51 30.62 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.034 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.848 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.08 -56.17 1.56 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.7 p -107.83 -20.12 13.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.162 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 68.63 70.74 0.29 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.84 0.353 . . . . 0.0 110.868 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 127' ' ' LEU . 3.9 tp -130.28 -165.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.842 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -105.48 99.35 1.56 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.678 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.705 HG23 HE21 ' A' ' 133' ' ' GLN . 16.1 mt -75.73 125.59 88.23 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.47 0.176 . . . . 0.0 110.719 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.613 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.8 Cg_exo -51.62 -180.0 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.141 1.894 . . . . 0.0 111.96 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 74.4 Cg_endo -77.32 -49.39 0.1 Allowed 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.398 2.065 . . . . 0.0 113.818 -179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.824 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.8 21.72 7.58 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.705 HE21 HG23 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -55.71 146.47 21.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.277 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.558 HG12 ' O ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -88.87 108.92 19.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.998 0.427 . . . . 0.0 111.028 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.516 HG12 ' HG ' ' A' ' 15' ' ' LEU . 12.0 p -153.25 159.33 3.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.105 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.493 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.77 137.64 35.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.666 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.477 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.1 OUTLIER -105.01 150.86 24.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.852 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -92.43 96.49 10.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.698 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 51.86 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.178 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.413 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -93.57 -46.88 7.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.843 -177.908 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 7.9 m-85 -87.27 166.92 14.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.679 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.477 HG23 ' CG ' ' A' ' 137' ' ' ARG . 7.3 p -119.82 127.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.785 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.848 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 4.3 m-85 -110.06 134.78 51.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.989 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 71.1 m80 -59.52 138.95 57.53 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.853 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.41 HD23 ' OE1' ' A' ' 133' ' ' GLN . 0.8 OUTLIER -60.43 -19.64 57.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -85.06 -37.88 19.8 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.9 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.7 p -98.16 12.88 33.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.852 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 3.4 t80 -86.14 121.92 29.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.735 0.302 . . . . 0.0 110.832 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.98 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.122 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 150.08 24.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 152' ' ' VAL . 4.7 m -66.08 -30.32 49.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.114 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 151' ' ' VAL . 27.9 t -111.81 -52.2 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.108 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 15.3 m -65.99 -28.05 68.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt 57.66 32.58 22.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.998 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -111.93 133.96 53.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.625 ' O ' HD13 ' A' ' 157' ' ' LEU . 6.0 mt-30 -62.3 157.91 18.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.124 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.735 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.3 OUTLIER -126.74 125.41 41.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -104.05 177.73 4.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.409 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.585 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.1 m -45.61 129.31 8.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.668 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.88 -27.09 15.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.792 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.58 128.97 39.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.76 0.314 . . . . 0.0 110.793 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.543 ' HA ' HG23 ' A' ' 9' ' ' VAL . 40.2 mt-10 -87.91 129.61 35.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.039 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.66 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 10.9 p90 -150.75 154.13 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.006 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.617 ' CE1' HG23 ' A' ' 7' ' ' VAL . 19.6 m-85 -106.46 171.02 7.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.852 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -128.47 111.03 12.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.827 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.91 -178.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.947 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -27.52 33.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -97.5 29.68 3.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.076 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.48 83.63 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.413 ' HB3' HG11 ' A' ' 151' ' ' VAL . 8.6 mtp180 -150.37 147.12 27.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.852 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.99 121.03 32.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.407 ' O ' HG13 ' A' ' 172' ' ' VAL . 9.4 p -145.09 126.39 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.949 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.1 p -78.07 -175.39 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.818 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -78.57 -26.94 45.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.13 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.94 78.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.35 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -103.92 -4.51 23.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.673 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -56.99 -66.19 0.49 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.75 -27.2 64.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.873 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 -39.75 61.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.12 4.05 51.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.599 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.04 -177.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.957 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.86 0.362 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -74.0 -73.94 0.21 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -107.48 146.59 31.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 4' ' ' VAL . 7.8 m -122.06 83.09 44.34 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.111 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.52 -61.63 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.568 2.178 . . . . 0.0 112.291 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -155.49 85.7 1.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.935 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.621 HG23 ' CE1' ' A' ' 164' ' ' TYR . 11.0 p -126.0 158.83 35.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.486 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -112.45 -176.94 3.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.643 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.462 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.1 p -155.14 136.53 5.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.345 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.3 t -61.38 145.54 12.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.649 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.14 -171.07 13.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.429 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.6 mt-10 -61.03 149.19 82.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.932 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.0 Cg_endo -78.27 138.79 16.21 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.593 2.195 . . . . 0.0 112.373 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -164.11 142.91 7.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.265 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -119.82 173.54 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.129 0.49 . . . . 0.0 111.455 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.469 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.44 -36.13 82.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.801 179.851 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.882 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.53 98.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.544 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.33 -76.95 0.12 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.568 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 61.05 77.37 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.785 0.326 . . . . 0.0 110.837 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.513 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 11.1 p90 -59.43 -39.51 83.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 65.17 179.77 8.05 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.638 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.555 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.9 p30 -57.63 -21.98 42.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.692 0.282 . . . . 0.0 111.195 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -54.45 -27.62 38.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -77.91 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.943 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 53.6 tp10 -92.75 156.28 17.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.991 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -76.02 100.05 4.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.839 HD21 ' HG2' ' A' ' 100' ' ' ARG . 2.4 tp -65.22 160.15 22.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 88' ' ' LEU . 1.6 pt -63.0 141.29 18.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.9 m -115.96 106.97 14.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.752 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -78.47 101.91 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.794 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.469 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -141.94 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.965 -179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -69.22 156.96 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -100.78 -170.07 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -98.83 -33.29 10.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.64 173.13 1.8 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.423 ' CE2' ' HD3' ' A' ' 73' ' ' ARG . 0.7 OUTLIER -176.24 -43.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -128.49 31.55 4.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.911 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.32 -31.23 63.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.961 ' HB3' HD13 ' A' ' 71' ' ' LEU . . . -162.62 108.84 1.22 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.056 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.67 -175.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.919 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.27 -63.52 0.3 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.476 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.458 HG23 ' O ' ' A' ' 42' ' ' ILE . 9.8 tp -54.68 125.06 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 0.0 111.423 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 60.4 178.63 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.74 84.55 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -82.97 125.17 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.868 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.69 140.76 5.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.503 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.22 -50.68 1.07 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.558 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.2 t -99.88 140.38 34.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.337 . . . . 0.0 110.854 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.98 135.7 8.44 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.536 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -171.41 114.1 0.52 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.451 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 -93.22 138.85 31.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.78 0.324 . . . . 0.0 110.956 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.2 ttp -85.23 -56.83 3.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -60.5 -94.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.553 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.78 -68.55 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 59.53 165.12 0.14 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.503 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 157.1 -162.33 31.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.506 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.11 89.52 2.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.653 0.263 . . . . 0.0 110.933 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.73 161.86 41.92 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.528 2.152 . . . . 0.0 112.191 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 59.73 31.18 20.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.721 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -104.72 134.73 19.51 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.046 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.8 Cg_endo -60.8 125.94 18.46 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.405 2.07 . . . . 0.0 112.102 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.71 140.44 32.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 p -57.59 164.2 2.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.0 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -85.12 114.67 22.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.569 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.13 -72.82 0.38 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.558 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.3 p -100.72 154.04 18.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.785 0.326 . . . . 0.0 110.962 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -76.03 86.22 2.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.158 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.04 127.63 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.721 ' CD2' HG21 ' A' ' 60' ' ' ILE . 10.1 p80 -63.97 161.84 15.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.933 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.574 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.8 mm -94.5 153.09 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.968 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.961 HD13 ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -162.12 30.34 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.921 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -103.67 176.16 5.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.934 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.423 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -83.06 -78.32 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.708 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.26 97.37 0.93 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.755 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.633 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.9 141.34 20.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.633 ' H ' HD13 ' A' ' 75' ' ' ILE . 8.6 mp -89.81 106.98 18.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.621 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -90.9 115.53 28.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.752 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -157.02 158.93 37.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.261 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.789 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 59.33 36.77 23.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.077 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.18 30.22 17.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -168.22 178.77 4.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.452 ' HB2' HD12 ' A' ' 75' ' ' ILE . 27.3 p-80 -96.56 125.05 40.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.789 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.8 m95 -113.72 133.21 55.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.772 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.456 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.69 173.1 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -79.99 -40.65 27.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -90.97 -30.71 16.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -67.3 -31.03 71.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.983 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 28' ' ' ILE . 22.8 tp -71.7 81.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -138.55 164.11 30.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.14 146.89 43.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.925 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.17 -27.41 68.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.059 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -111.73 -57.77 2.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.038 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -59.25 -45.17 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.068 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 61.09 23.25 13.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.1 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.505 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 m -86.57 157.77 55.05 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.164 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.14 118.96 5.93 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.482 2.121 . . . . 0.0 112.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 95' ' ' VAL . 7.1 mp -110.05 35.95 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.659 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.54 -17.82 63.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.559 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.816 ' C ' HD11 ' A' ' 28' ' ' ILE . 14.6 mt-10 -91.35 -55.34 3.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.755 0.312 . . . . 0.0 110.987 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.839 ' HG2' HD21 ' A' ' 27' ' ' LEU . 1.4 mpt_? -142.6 160.97 39.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.849 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.577 ' HB3' HG23 ' A' ' 28' ' ' ILE . 52.8 t -157.06 127.95 6.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.532 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.5 OUTLIER -105.89 160.63 15.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -139.75 157.62 45.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 109' ' ' TYR . 2.8 mmp_? -141.31 172.06 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.818 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.78 68.48 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.566 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -90.08 -71.1 0.63 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.784 0.326 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.06 -173.23 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.972 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.5 p -99.5 123.33 52.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.16 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.421 ' CE2' ' HG3' ' A' ' 104' ' ' ARG . 1.1 m-85 -121.49 161.57 22.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 15.1 p -82.92 168.38 17.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.713 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 1.0 OUTLIER -57.9 -35.99 71.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.022 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.437 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 4.4 t70 -76.33 -23.6 54.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.194 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.6 -21.06 49.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.407 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.513 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 11.6 t80 -67.64 -44.89 76.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.813 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.497 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 17.3 m-85 -59.6 -42.89 93.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.871 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.71 -28.01 40.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.5 mmt-85 -78.08 -54.97 5.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.217 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -110.88 -43.06 3.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.168 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.15 168.88 3.89 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.636 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 84.8 m -65.3 153.26 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.741 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.24 162.1 37.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.555 ' CA ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -77.94 128.67 34.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.34 30.67 3.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.04 -49.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 30.9 p -116.57 -0.92 12.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.421 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 127' ' ' LEU . 2.2 mp0 62.6 69.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.922 0.391 . . . . 0.0 110.928 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 126' ' ' GLN . 1.1 mp -146.83 143.0 28.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.778 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.4 104.34 1.84 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.702 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.555 HD11 ' CA ' ' A' ' 122' ' ' CYS . 1.7 mp -72.07 138.23 82.0 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.507 0.194 . . . . 0.0 110.708 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 94.6 Cg_exo -43.08 171.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.746 2.297 . . . . 0.0 112.844 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.39 -55.2 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.835 2.357 . . . . 0.0 113.828 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.882 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.95 21.46 7.52 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.243 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.604 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.5 OUTLIER -63.43 139.11 58.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.484 179.768 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.932 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -73.44 108.76 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.039 0.447 . . . . 0.0 111.007 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.7 p -146.11 160.47 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.85 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.514 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.32 134.85 38.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.45 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -114.13 130.57 56.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.923 -179.576 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -66.59 96.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.72 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.76 -88.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.491 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 138' ' ' ALA . 19.4 p-10 -89.24 -43.89 10.66 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.879 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CD2' ' OD1' ' A' ' 140' ' ' ASP . 5.8 m-85 -89.32 164.14 15.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.989 0.423 . . . . 0.0 111.682 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.486 ' CG1' HD13 ' A' ' 129' ' ' ILE . 9.3 p -114.04 149.33 16.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.71 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -132.3 174.91 9.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.383 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.412 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 47.2 m80 -98.22 144.21 27.9 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.879 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.655 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -63.01 -17.92 62.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.389 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.25 -47.95 7.2 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.798 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -84.4 -31.61 24.6 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.676 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.855 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 31.7 t80 -56.84 110.19 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.351 . . . . 0.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -161.17 -176.97 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.074 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.5 150.03 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.019 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 171' ' ' LEU . 11.7 m -64.73 -29.42 47.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.749 HG23 HG23 ' A' ' 151' ' ' VAL . 21.1 t -110.9 -51.6 6.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.184 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 38.4 m -65.94 -28.09 68.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm 53.15 30.6 10.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -111.1 140.03 45.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.431 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.9 mp0 -61.78 156.17 21.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.901 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.708 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -117.88 168.11 10.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.844 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.1 168.85 19.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.022 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.6 t -47.96 126.69 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.26 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.47 -25.27 27.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.736 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.462 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.3 t70 -66.63 128.82 37.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.698 0.285 . . . . 0.0 110.656 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -91.38 119.07 31.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.19 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.643 ' CD2' HD23 ' A' ' 171' ' ' LEU . 3.4 p90 -138.71 164.6 29.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.837 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.621 ' CE1' HG23 ' A' ' 7' ' ' VAL . 76.8 m-85 -112.63 156.84 22.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.862 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.525 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -116.19 113.33 22.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.7 mmt -58.13 177.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -58.28 -49.02 78.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.993 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -74.3 -78.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 40.7 p -177.24 37.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.796 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -93.3 144.93 24.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.855 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -94.59 120.96 35.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.603 HG13 ' HB2' ' A' ' 164' ' ' TYR . 10.0 p -139.73 130.58 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.068 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.6 p -86.13 -172.4 4.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.428 ' NZ ' HG21 ' A' ' 7' ' ' VAL . 1.1 mptp? -63.75 -57.76 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.032 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.38 -29.44 48.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.297 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.472 ' CB ' HG23 ' A' ' 172' ' ' VAL . 58.1 m-20 -90.04 -23.46 21.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.467 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.3 t80 -56.12 -66.12 0.48 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.953 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.26 -44.91 94.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 65.9 m -61.26 -31.5 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -76.07 -51.35 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.69 -67.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' GLN . . . . . 0.421 ' HB3' ' CE2' ' A' ' 177' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.875 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.856 0.36 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.96 114.43 28.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.469 ' O ' HG13 ' A' ' 4' ' ' VAL . 5.1 tp-100 67.73 -69.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.998 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.703 HG21 ' CG1' ' A' ' 7' ' ' VAL . 14.8 m -157.66 149.36 17.11 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.098 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.51 -45.55 1.15 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.526 2.151 . . . . 0.0 112.375 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.56 82.3 0.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.703 ' CG1' HG21 ' A' ' 4' ' ' VAL . 12.1 p -95.8 158.63 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.067 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.558 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.62 -176.94 6.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.558 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -150.77 150.61 13.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.352 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.737 HG21 ' HB3' ' A' ' 157' ' ' LEU . 24.3 t -66.92 146.42 13.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.831 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.7 -179.65 16.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.385 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -57.4 139.39 80.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.475 0.179 . . . . 0.0 110.678 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.651 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.84 140.49 61.38 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.364 2.043 . . . . 0.0 112.493 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -166.14 142.94 5.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.257 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.801 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -114.89 173.26 6.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.079 0.466 . . . . 0.0 111.333 -179.553 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.635 ' HE3' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -62.77 -34.35 77.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.788 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.851 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.18 65.23 3.66 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.417 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -153.6 82.22 0.17 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.622 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -84.2 5.05 27.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.547 0.213 . . . . 0.0 111.225 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 2.9 m-85 69.89 -67.04 0.25 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.36 133.88 3.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.597 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.02 -30.39 26.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.904 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.88 -31.15 71.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.52 -75.09 0.05 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG2' ' CD1' ' A' ' 102' ' ' PHE . 9.1 tp10 -60.06 165.37 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.878 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -75.91 99.95 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.719 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 100' ' ' ARG . 3.1 tp -86.0 165.0 17.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.012 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.854 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.96 149.92 9.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.9 m -122.59 106.88 11.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.796 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -80.62 101.76 9.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.505 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.17 166.04 27.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.036 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -81.26 157.04 25.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.96 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -102.78 174.47 5.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 p -103.0 35.92 2.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -128.4 161.73 28.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -166.25 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -150.61 80.22 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.79 -68.97 0.8 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.12 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.14 117.13 7.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 60.61 31.49 20.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.39 -102.99 0.52 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 42' ' ' ILE . 10.7 tp -54.65 128.88 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.805 0.336 . . . . 0.0 111.424 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 60.55 158.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.94 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.97 141.53 33.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.897 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.27 -32.77 69.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.84 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.7 -148.18 21.65 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.544 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.09 71.33 0.26 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.555 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.4 m -95.01 114.16 25.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.308 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.61 86.64 0.83 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 140.61 -159.15 26.31 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.491 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 60.57 33.13 20.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.842 0.353 . . . . 0.0 110.88 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.0 ttp 60.41 80.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.878 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -95.55 -28.54 9.53 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.499 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 162.72 5.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.89 -138.64 14.28 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.516 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 136.14 179.82 17.06 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.528 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.34 83.0 1.05 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.909 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.03 168.98 19.03 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.527 2.151 . . . . 0.0 112.156 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 57.85 29.88 18.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.866 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.437 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.1 tp -98.69 135.18 21.12 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.056 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.3 Cg_endo -60.35 125.87 18.58 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.35 2.034 . . . . 0.0 111.964 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -102.71 151.14 22.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.153 -179.622 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.451 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 4.5 t -58.16 137.73 56.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.787 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -62.5 114.65 3.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.172 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.05 25.68 39.81 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.11 -178.9 4.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.931 0.396 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -112.76 -30.74 6.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.182 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.95 -168.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.063 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 62' ' ' MET . 2.1 p80 -102.36 172.42 6.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.655 ' C ' HD23 ' A' ' 71' ' ' LEU . 12.8 mm -98.06 154.13 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.297 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.655 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -167.02 32.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.68 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -99.17 -179.06 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.894 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.25 -67.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.55 133.65 33.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.067 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.435 ' C ' HD12 ' A' ' 76' ' ' LEU . 41.9 mm -138.89 151.42 23.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.111 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 76' ' ' LEU . 6.2 mp -105.05 106.95 17.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.528 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -90.96 115.02 27.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -147.75 159.4 43.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.071 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.527 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.33 36.1 24.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.076 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.47 39.59 11.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -174.03 162.89 3.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 43.1 p-80 -86.79 117.88 25.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.959 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.527 ' NE1' HD12 ' A' ' 79' ' ' LEU . 86.0 m95 -108.09 124.6 50.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.74 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.09 174.45 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.964 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -80.06 -38.37 32.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.353 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -91.19 -22.17 20.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.958 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.7 m -95.53 26.76 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.854 HD21 HG21 ' A' ' 28' ' ' ILE . 56.0 tp -129.89 88.68 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.835 0.35 . . . . 0.0 111.023 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 161.54 37.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -59.02 147.0 36.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -75.6 -31.07 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -95.8 -60.6 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -60.25 -34.83 74.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.873 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 58.19 31.15 20.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.014 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.467 ' O ' HD13 ' A' ' 97' ' ' LEU . 17.0 t -97.86 133.01 23.8 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.1 118.97 3.1 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.542 2.162 . . . . 0.0 112.557 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 95' ' ' VAL . 5.6 mp -101.86 77.47 1.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.825 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -108.92 38.15 2.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -152.68 -66.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.611 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -127.04 133.86 50.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.736 ' SG ' HD11 ' A' ' 88' ' ' LEU . 1.9 t -123.36 128.04 49.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.907 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.418 ' CD1' ' HG2' ' A' ' 25' ' ' GLU . 0.4 OUTLIER -112.35 153.64 26.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.2 t -127.43 117.82 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.881 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -149.71 123.96 9.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.47 50.22 45.39 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.482 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 68.91 -67.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 m -58.43 151.2 20.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.952 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.06 134.76 27.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.047 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -122.94 156.38 34.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.937 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.4 p -112.78 135.94 52.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.692 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.447 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -51.97 -35.57 46.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.188 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -45.14 -48.89 12.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.45 -20.8 33.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.85 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.46 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 11.1 t80 -64.13 -34.96 79.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.447 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 40.6 m-85 -65.11 -40.94 95.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.93 0.395 . . . . 0.0 110.756 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -74.8 -56.52 4.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.311 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -73.49 -51.92 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.468 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 96.6 m-85 -98.53 37.01 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.203 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.99 -143.71 3.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.635 ' HB ' ' HE3' ' A' ' 16' ' ' MET . 80.7 m -103.07 155.0 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.711 0.291 . . . . 0.0 110.814 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -151.62 158.42 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.875 0.369 . . . . 0.0 111.191 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.468 ' HA ' HD11 ' A' ' 129' ' ' ILE . 52.1 t -74.28 136.78 42.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.722 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.46 30.23 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.23 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -58.15 1.47 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 18.0 p -110.37 18.2 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.211 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 54.41 28.37 9.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.778 0.323 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.426 HD23 ' CE1' ' A' ' 144' ' ' HIS . 14.4 tp -100.86 134.71 43.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.829 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.0 110.87 3.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.625 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.786 HG22 HD11 ' A' ' 15' ' ' LEU . 11.4 mt -63.7 139.56 97.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.555 0.216 . . . . 0.0 110.895 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.573 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 91.9 Cg_exo -44.59 172.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.672 2.248 . . . . 0.0 112.598 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.09 -55.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.908 2.405 . . . . 0.0 114.464 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.851 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.32 21.39 7.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.573 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 67.0 mm-40 -61.22 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.471 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.768 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -118.81 112.16 36.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.946 0.403 . . . . 0.0 111.079 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.801 HG12 ' HG ' ' A' ' 15' ' ' LEU . 8.7 p -157.05 161.39 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.733 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.531 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.25 134.92 38.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.639 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.837 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -113.91 136.57 52.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.811 -179.73 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -72.68 96.32 1.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.861 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.438 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 38.1 -89.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.2 m-20 -79.05 -38.5 36.3 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.205 -177.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.41 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.7 m-85 -105.84 168.19 9.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.837 HG22 ' CB ' ' A' ' 137' ' ' ARG . 46.9 t -122.58 148.12 26.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.514 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.572 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.9 m-85 -133.56 170.18 15.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.118 0.485 . . . . 0.0 111.733 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 0.1 OUTLIER -65.83 168.78 7.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.907 179.729 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.768 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.5 mp -81.04 -29.96 34.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 177.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -91.42 -49.3 6.41 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.11 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 79.7 m -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.245 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.675 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.6 t80 -56.84 114.58 2.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.021 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.1 -177.02 1.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 153' ' ' CYS . 30.6 t -97.68 150.07 21.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 152' ' ' VAL . 21.3 m -66.81 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -106.22 -55.88 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.345 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 150' ' ' CYS . 25.8 m -65.84 -28.19 68.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.005 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? 54.73 31.65 15.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.69 146.83 46.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.855 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.6 mp0 -62.19 154.13 28.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.737 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.7 mm? -112.16 123.27 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -98.88 157.67 16.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.0 t -44.69 133.51 5.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.26 -32.98 6.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.628 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.519 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -67.15 131.06 45.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 0.0 110.812 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.04 113.89 24.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.031 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.784 ' CD2' HD23 ' A' ' 171' ' ' LEU . 9.0 p90 -126.49 153.27 45.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.927 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m-85 -102.16 163.27 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.743 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.6 tp -120.7 112.11 18.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.801 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.14 167.85 2.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.36 -29.65 67.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.5 -79.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.038 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.43 38.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.823 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -105.54 117.58 34.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.784 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -69.4 127.22 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.07 126.66 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.056 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.1 m -58.77 -170.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.811 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -73.42 -55.86 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.71 -43.91 97.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.101 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -59.37 -25.76 64.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.056 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -55.83 -66.09 0.48 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.999 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -56.44 -28.14 58.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.118 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -30.5 43.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.985 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -90.45 -29.18 18.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.246 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm 61.88 174.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.847 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.853 -179.917 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.811 0.339 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t -154.98 161.63 41.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -175.63 115.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -131.79 150.34 75.94 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.075 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 -167.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.529 2.153 . . . . 0.0 112.298 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -124.51 112.58 17.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.491 HG22 ' N ' ' A' ' 8' ' ' MET . 10.9 p -126.05 158.6 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.072 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -139.51 -177.4 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.639 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.443 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.9 p -155.06 135.7 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.227 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' A' ' 163' ' ' PHE . 57.5 t -58.9 146.17 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.01 -153.18 8.7 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.664 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 60.0 mt-10 -67.66 141.51 95.19 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.534 0.207 . . . . 0.0 110.748 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.604 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.0 Cg_endo -83.03 129.91 5.48 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.716 2.277 . . . . 0.0 112.396 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -156.43 155.17 31.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.349 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.558 HD21 ' CG1' ' A' ' 135' ' ' VAL . 8.2 mt -136.28 173.38 11.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.874 0.369 . . . . 0.0 111.091 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.409 ' HE3' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.66 -50.66 32.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.777 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.857 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 63.13 88.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.583 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.98 -41.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.424 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 58.4 23.27 10.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.75 0.31 . . . . 0.0 111.026 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 56.95 -172.91 0.08 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.872 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.18 136.76 7.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.89 -31.23 61.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.748 0.308 . . . . 0.0 110.854 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.15 -27.9 61.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.038 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -56.31 -31.18 63.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.025 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.7 OUTLIER -113.01 174.19 6.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -75.98 121.61 22.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.834 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 100' ' ' ARG . 3.1 tp -105.13 163.68 12.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.839 HG23 ' HB2' ' A' ' 101' ' ' CYS . 8.3 pt -63.04 146.31 12.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.139 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.402 HG22 ' HG ' ' A' ' 31' ' ' LEU . 50.3 m -113.46 106.84 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.833 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -77.08 101.75 6.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.491 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.03 155.9 42.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.968 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -77.72 152.35 33.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -99.24 -27.52 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.409 ' O ' HG22 ' A' ' 34' ' ' THR . 8.8 m 63.37 37.56 10.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.817 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -124.44 73.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.836 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE2' ' NH1' ' A' ' 73' ' ' ARG . 2.2 t80 -70.55 -44.4 67.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.624 ' CG ' HD11 ' A' ' 42' ' ' ILE . 3.9 m-20 -102.06 141.32 35.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.902 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.12 -40.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.068 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -166.09 107.08 0.71 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 60.35 35.33 20.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -96.62 -29.07 8.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.499 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.631 ' N ' HD12 ' A' ' 42' ' ' ILE . 2.5 mp -84.19 -72.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.816 0.341 . . . . 0.0 110.858 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.85 -177.13 2.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.872 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -132.83 125.34 29.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -60.37 162.57 6.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.899 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.85 59.1 0.64 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.569 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -161.3 146.79 12.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.491 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -131.72 -46.46 0.96 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 0.0 110.936 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.91 -97.95 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.529 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.75 -162.21 2.54 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.523 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -155.43 100.58 2.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.806 0.336 . . . . 0.0 110.851 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 43.3 mtp -144.08 118.75 9.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.901 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.05 77.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.534 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.6 m 60.55 171.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 110.926 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -103.9 -157.51 24.32 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.433 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -91.2 -160.87 36.84 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.483 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.51 87.5 14.19 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.638 0.256 . . . . 0.0 110.9 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.47 165.53 1.02 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.558 2.172 . . . . 0.0 112.265 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 59.71 31.16 20.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.447 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -106.29 134.93 19.56 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.053 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.6 Cg_endo -60.14 125.9 18.79 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.405 2.07 . . . . 0.0 112.031 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.5 mtt -99.19 135.94 39.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.43 ' HB2' ' CG1' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -58.03 147.54 29.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.654 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.486 ' HB1' ' CE3' ' A' ' 83' ' ' TRP . . . -62.12 114.82 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.068 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 97.37 -22.24 41.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.967 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.76 -178.82 6.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -144.4 46.88 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.01 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -150.68 -83.35 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.014 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 176.03 -177.55 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.933 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.688 ' C ' HD23 ' A' ' 71' ' ' LEU . 7.7 mm -126.93 153.72 36.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.688 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -172.79 35.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.886 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HB2' HD11 ' A' ' 75' ' ' ILE . 23.8 m-20 -100.3 -179.54 4.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' NH1' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -81.73 -79.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.548 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.4 OUTLIER -77.92 132.75 38.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.548 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.5 mm -136.03 152.48 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.115 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.0 mp -106.97 106.91 17.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.437 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -90.84 120.83 32.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.677 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.87 154.75 34.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.114 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.883 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.74 37.72 28.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.21 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.72 40.68 12.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.911 0.386 . . . . 0.0 111.145 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -176.64 159.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.822 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.44 ' CD2' HG13 ' A' ' 70' ' ' ILE . 29.9 p-80 -85.17 117.93 24.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.883 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 77.9 m95 -106.93 122.92 47.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.608 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.482 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.98 151.84 11.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.894 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -59.01 -35.89 74.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.843 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mttt -91.15 -48.9 6.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.94 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 21.0 m -58.48 -27.95 64.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.117 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.667 HD21 HG21 ' A' ' 28' ' ' ILE . 54.6 tp -72.17 88.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 96' ' ' PRO . 24.3 mmtt -134.96 159.29 41.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 53.3 t -60.75 147.03 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.79 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -62.59 -39.91 95.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.506 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -99.7 -63.12 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.434 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.2 m -56.36 -33.23 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.314 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 53.68 24.98 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.026 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -86.03 161.51 49.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.261 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HA ' ' HD3' ' A' ' 89' ' ' LYS . 51.2 Cg_exo -54.18 118.96 5.58 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.594 2.196 . . . . 0.0 112.309 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 mp -126.83 74.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.809 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -116.64 30.98 7.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -137.43 -55.04 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.451 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.71 135.07 47.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.933 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.839 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.6 t -113.02 163.87 14.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.834 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.9 t80 -165.32 120.95 1.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 90.1 p -151.98 172.35 16.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -167.43 123.99 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.5 -87.1 1.31 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.471 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -150.77 36.25 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.883 0.373 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.7 m -156.23 142.5 18.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.1 p -112.6 115.98 51.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -130.08 121.03 25.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.84 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.0 p -49.63 173.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.224 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 11.7 mtpt -78.16 -28.79 48.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.452 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.4 t70 -52.91 -52.91 56.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.264 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -84.05 -20.7 32.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.277 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.484 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 14.4 t80 -61.48 -33.3 73.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.0 110.758 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.6 m-85 -59.71 -45.34 92.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.77 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -74.68 -27.02 60.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.005 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -64.2 -54.99 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.223 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -117.03 -42.99 2.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -56.93 171.89 2.46 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -58.93 149.22 27.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.789 0.328 . . . . 0.0 110.931 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -150.88 162.13 41.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 16.1 t -79.0 155.8 28.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.953 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -111.09 -20.56 12.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.363 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.485 ' HB2' ' CD2' ' A' ' 143' ' ' TYR . . . -78.22 -58.03 3.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.05 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.26 -12.08 21.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.186 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 36.75 12.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.5 tp -109.49 144.17 38.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.44 104.25 0.74 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.553 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 142' ' ' VAL . 64.8 mt -61.42 140.38 94.75 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.638 0.256 . . . . 0.0 110.987 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.568 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 83.8 Cg_exo -43.97 170.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.874 2.383 . . . . 0.0 112.814 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.35 -55.58 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.479 2.12 . . . . 0.0 114.831 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.857 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.63 21.48 7.07 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 84.2 mm-40 -59.57 -178.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.791 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.604 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -122.52 114.35 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.071 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.564 HG22 ' N ' ' A' ' 136' ' ' ARG . 11.4 p -157.05 164.56 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.564 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -95.8 137.68 34.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.346 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.519 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.61 133.52 49.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.018 -179.267 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.632 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -67.96 96.31 0.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.761 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.427 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 39.97 -89.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.4 t70 -80.64 -39.53 27.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.377 -177.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 138' ' ' ALA . 2.9 m-85 -106.65 173.35 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.852 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.9 p -126.65 149.0 31.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.604 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.632 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.6 m-85 -131.88 158.88 40.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 111.364 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 76.7 m80 -71.53 137.92 48.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.042 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.54 -17.79 60.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.33 -37.37 21.7 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.393 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 7.7 p -96.43 -19.05 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.73 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 4.8 t80 -60.1 119.53 8.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.708 0.29 . . . . 0.0 110.804 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.02 -176.87 1.77 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.207 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.67 150.06 25.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 5.4 m -68.98 -30.16 45.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.143 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -109.48 -52.61 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.173 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 13.8 m -66.04 -28.1 68.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.005 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 58.01 34.58 24.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.995 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -115.47 137.33 52.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.449 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.7 mt-30 -64.63 155.25 33.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.025 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.693 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.1 mm? -115.44 164.25 14.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.682 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.08 169.34 18.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.418 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 m -42.79 122.19 2.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.71 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.24 -22.87 36.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.724 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.443 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.9 t70 -64.35 128.88 37.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 110.774 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 53.6 mt-10 -91.31 115.35 27.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -137.44 169.26 18.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.021 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.531 ' HB2' HG13 ' A' ' 172' ' ' VAL . 87.2 m-85 -115.51 171.01 7.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.628 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.9 OUTLIER -124.93 116.45 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.821 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mtp -72.26 -176.24 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.976 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.01 -26.22 31.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.18 30.33 2.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.049 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 12.9 p 58.32 45.35 17.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.025 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.06 155.3 19.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -105.06 123.47 47.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.531 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.9 p -142.54 125.26 13.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.06 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 23.3 p -78.53 -171.0 2.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.951 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -79.1 -30.18 43.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.149 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.55 -34.94 79.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.389 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -104.14 4.11 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.594 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 8.8 t80 -65.93 -66.12 0.59 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 110.778 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -59.12 -26.06 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.032 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.5 m -72.98 -27.69 61.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.093 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.35 -32.12 12.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.914 0.387 . . . . 0.0 110.738 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' LYS . . . . . 0.446 ' HE3' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER 179.29 171.54 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.929 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.876 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.896 0.379 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 t -170.8 -171.14 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -71.43 146.3 48.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.717 HG23 ' OD1' ' A' ' 6' ' ' ASP . 6.2 m -101.81 150.33 37.27 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -51.73 -27.37 26.39 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.585 2.19 . . . . 0.0 112.375 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.717 ' OD1' HG23 ' A' ' 4' ' ' VAL . 7.2 m-20 61.24 101.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.442 HG22 ' N ' ' A' ' 8' ' ' MET . 12.8 p -96.91 155.64 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.195 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.576 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -154.98 -173.12 4.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.627 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.412 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.0 p -155.06 144.8 13.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.223 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 32.6 t -67.79 146.2 13.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.688 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -129.92 -176.18 14.33 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.629 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 3.6 mm-40 -59.85 148.2 76.95 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 120.573 0.225 . . . . 0.0 110.775 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.837 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.6 Cg_exo -77.92 137.02 15.38 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.642 2.228 . . . . 0.0 112.586 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.01 142.85 5.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.985 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.807 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -120.53 173.6 7.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.202 0.525 . . . . 0.0 111.445 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.567 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -71.17 -28.84 64.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.017 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.957 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.72 56.28 26.16 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.304 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.52 -50.17 70.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.6 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 70.08 -64.81 0.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.48 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER 62.85 163.14 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.907 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.46 -170.94 44.1 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.577 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -59.19 -28.47 66.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 0.0 111.078 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -56.64 -29.47 62.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.52 -75.28 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' CG ' ' CE2' ' A' ' 102' ' ' PHE . 52.4 mm-40 -113.57 172.83 6.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.845 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ptp85 -76.04 144.49 40.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.673 HD21 ' HG2' ' A' ' 100' ' ' ARG . 1.5 tp -111.99 163.68 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.819 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 4.6 pt -62.93 161.83 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.176 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -130.81 106.85 8.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.3 101.8 7.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.534 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -142.62 150.36 40.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.431 ' HG3' ' CD1' ' A' ' 74' ' ' PHE . 2.8 mt-10 -68.48 157.06 36.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HG22 ' A' ' 34' ' ' THR . 2.4 m120 -123.7 19.5 9.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.226 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 33' ' ' ASN . 13.6 t 43.95 31.21 0.48 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.382 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -120.24 162.3 19.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -177.14 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -114.04 107.3 15.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.956 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.576 ' HB3' HD22 ' A' ' 71' ' ' LEU . . . -169.29 120.42 0.71 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.076 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.79 18.35 10.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.449 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 61.63 81.53 0.19 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.7 -83.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.513 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.641 ' N ' HD12 ' A' ' 42' ' ' ILE . 2.5 mp -84.25 -55.76 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -105.98 174.52 5.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.91 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -133.04 122.52 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.76 105.19 15.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.903 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.54 -61.51 0.21 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.482 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.04 28.54 9.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.39 141.07 45.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.848 0.356 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.86 97.41 1.35 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.493 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.91 28.73 5.8 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.445 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 84.84 1.59 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.346 . . . . 0.0 110.874 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.3 mtt -137.76 35.06 2.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.07 -33.15 0.15 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.539 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -60.31 -70.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.872 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -86.58 126.87 8.09 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.545 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -174.3 161.05 30.93 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.511 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.89 86.93 2.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.727 0.299 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.38 161.35 46.23 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.497 2.132 . . . . 0.0 112.246 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 60.2 33.84 21.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.514 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.6 tp -108.94 134.63 20.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.453 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.8 Cg_endo -60.17 125.99 19.0 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.435 2.09 . . . . 0.0 112.119 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.38 140.51 30.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.107 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.0 p -58.07 164.2 2.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.975 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.456 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.46 114.59 23.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.515 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.83 -69.81 0.46 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.6 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.1 p -105.25 153.77 21.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -74.52 87.13 2.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.21 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -179.22 133.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.644 ' CD2' HD23 ' A' ' 71' ' ' LEU . 17.4 p-80 -72.1 143.62 48.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 84' ' ' HIS . 4.9 mm -70.76 152.08 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.644 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.7 OUTLIER -174.21 35.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.91 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -107.53 162.84 13.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.925 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -59.64 -74.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.431 ' CD1' ' HG3' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -82.91 120.87 26.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.021 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.32 146.68 28.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.205 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.7 106.67 17.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.435 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -91.48 127.61 36.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -166.68 165.24 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.188 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.804 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.2 mt 59.25 37.25 23.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.109 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.83 29.52 17.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.014 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -169.89 -179.15 3.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.403 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 25.9 p-80 -97.2 124.63 41.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.87 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.804 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.4 m95 -115.77 130.58 56.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.718 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.564 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.99 170.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.909 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 p -80.02 -40.07 28.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.0 mttm -90.57 -26.85 19.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 68.4 m -71.06 -30.27 66.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.971 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.65 HD11 ' SG ' ' A' ' 101' ' ' CYS . 18.4 tp -76.6 80.3 3.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.852 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -135.94 153.18 51.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.71 135.48 48.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.766 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -29.21 68.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.063 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.24 -62.92 1.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.146 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.422 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.9 m -58.28 -34.98 71.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 55.33 23.72 5.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.112 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.5 m -85.97 156.37 57.9 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.216 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.55 118.95 5.92 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.497 2.131 . . . . 0.0 112.308 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.506 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.0 mp -104.02 65.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -98.05 30.25 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.111 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.797 ' C ' HD11 ' A' ' 28' ' ' ILE . 2.1 mm-40 -140.26 -51.94 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.673 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -132.25 174.36 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.74 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.2 t -157.01 141.6 16.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.449 ' CE2' ' CG ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -133.98 172.04 13.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -147.61 155.26 41.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -170.28 124.04 0.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.23 -90.62 0.36 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.444 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -153.87 36.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 m -153.21 153.08 32.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.3 p -85.71 116.02 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.04 160.19 20.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -97.98 171.22 8.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.743 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 102' ' ' PHE . 1.5 mttt -78.16 -32.9 50.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.477 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.5 -58.08 7.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.543 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -72.92 -20.83 61.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 4.4 t80 -64.38 -33.55 76.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 110.953 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 4.9 m-85 -79.15 -35.24 42.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.01 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -84.96 -59.05 2.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.284 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -71.54 -47.36 55.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.387 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -98.07 37.03 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.361 . . . . 0.0 111.064 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -149.06 -178.95 24.54 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.36 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.567 HG21 ' SD ' ' A' ' 16' ' ' MET . 72.4 m -60.11 153.53 21.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.794 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -144.44 174.27 11.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.126 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.734 ' HB2' HD11 ' A' ' 129' ' ' ILE . 41.8 t -93.4 130.76 39.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.799 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.456 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.81 29.53 3.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.111 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.687 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . . . -125.12 -53.27 1.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.26 -8.34 14.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.323 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 64.07 64.73 0.73 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.934 0.397 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 127' ' ' LEU . 5.2 tp -134.63 175.77 9.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -99.15 99.15 2.08 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.718 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.734 HD11 ' HB2' ' A' ' 122' ' ' CYS . 1.7 mp -74.45 138.14 74.6 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.424 0.154 . . . . 0.0 110.692 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.631 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 89.6 Cg_exo -44.4 173.2 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.596 2.197 . . . . 0.0 112.59 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.69 -55.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.861 2.374 . . . . 0.0 113.814 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.957 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -120.23 21.72 11.63 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.226 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.631 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.6 OUTLIER -67.95 137.55 55.25 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.584 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.837 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -74.14 108.77 5.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.807 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.3 p -143.08 158.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.773 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.41 134.81 39.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.893 0.378 . . . . 0.0 110.777 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -104.96 112.92 26.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.893 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.453 ' HB1' ' OE1' ' A' ' 139' ' ' GLN . . . -79.82 146.92 32.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.795 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.453 ' OE1' ' HB1' ' A' ' 138' ' ' ALA . 18.0 pm0 42.64 -142.28 0.11 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.334 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -89.74 35.26 0.83 Allowed 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.456 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 33.0 m-85 -151.41 169.0 23.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.914 0.388 . . . . 0.0 111.039 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.7 p -103.57 148.65 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.047 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.687 ' CZ ' ' HB2' ' A' ' 124' ' ' ALA . 6.9 m-85 -126.89 175.06 8.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.967 0.413 . . . . 0.0 111.21 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.458 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.8 m80 -104.95 136.85 43.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.648 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -55.75 -22.4 23.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 177.754 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.33 -36.0 14.1 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.674 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -97.14 1.65 50.18 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.458 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.5 t80 -86.03 115.84 23.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.777 0.323 . . . . 0.0 110.645 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.0 -176.95 1.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.259 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.54 150.21 20.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.025 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 152' ' ' VAL . 14.2 m -67.44 -27.29 38.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.289 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 151' ' ' VAL . 28.3 t -104.11 -55.7 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.424 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 30.1 m -65.94 -28.04 68.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.981 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm 57.53 28.5 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.999 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 34.2 mtm180 -121.74 147.75 45.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.425 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.7 mt-30 -66.76 153.43 43.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.038 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.702 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.1 mm? -115.89 139.93 49.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.728 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -107.37 167.0 10.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.163 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 t -46.79 138.55 6.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.33 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.33 -32.59 6.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.499 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.412 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.5 m-20 -63.81 128.92 37.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.766 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.404 ' HA ' HG23 ' A' ' 9' ' ' VAL . 11.7 mt-10 -93.7 116.18 28.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.994 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.65 ' CD2' HD23 ' A' ' 171' ' ' LEU . 13.8 p90 -126.91 166.28 17.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.917 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 23.4 m-85 -117.27 171.17 8.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.144 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 168' ' ' ASP . 1.2 tp -124.38 111.02 15.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.429 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 2.8 mmt -60.94 -89.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.264 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -83.23 -49.16 9.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.802 0.334 . . . . 0.0 111.097 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ASP . . . . . 0.496 ' O ' HD21 ' A' ' 165' ' ' LEU . 2.3 t0 176.82 -38.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.748 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 33.7 p -115.4 30.76 7.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.9 mtt180 -120.48 132.21 55.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.65 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -103.84 123.69 47.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.837 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.512 HG13 ' O ' ' A' ' 172' ' ' VAL . 13.4 p -145.07 118.92 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.094 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.3 m -55.37 -176.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.015 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -69.31 -49.0 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.17 84.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -59.45 -25.95 64.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.937 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -54.54 -65.31 0.6 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.018 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -54.13 -23.49 14.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.304 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.0 m -87.07 -26.77 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -52.07 4.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.487 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 171.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.927 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 -179.959 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.39 79.88 8.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 118.3 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.4 ' O ' HG23 ' A' ' 4' ' ' VAL . 5.2 m -59.96 109.87 2.34 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.135 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.02 -42.58 3.02 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.381 2.054 . . . . 0.0 112.298 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -156.52 115.85 3.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.976 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 11.0 p -125.93 158.72 34.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.092 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -146.1 -179.3 6.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.679 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.4 p -155.02 135.38 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.29 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' CD1' ' A' ' 163' ' ' PHE . 41.3 t -59.03 146.27 9.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.489 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -136.12 -159.75 8.57 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.743 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.33 123.27 69.35 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.514 0.197 . . . . 0.0 110.901 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.566 ' HB2' HG12 ' A' ' 134' ' ' VAL . 23.1 Cg_exo -62.03 138.42 72.96 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.309 2.006 . . . . 0.0 112.263 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -166.03 148.56 7.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.781 HD11 HG22 ' A' ' 129' ' ' ILE . 1.1 mt -116.84 173.4 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.294 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.437 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.58 -37.09 77.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.866 179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.9 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.44 81.54 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.543 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.84 -72.29 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 60.67 86.87 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.782 0.325 . . . . 0.0 110.826 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.524 ' CZ ' ' CE1' ' A' ' 115' ' ' PHE . 29.7 p90 -59.79 -44.47 93.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.036 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.436 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 57.39 -120.91 23.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.563 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -83.94 -23.86 30.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.733 0.301 . . . . 0.0 111.168 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.99 -29.98 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.175 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.19 -73.55 0.39 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.874 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 19.9 tp10 -120.99 163.49 18.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 147.87 38.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.3 mm? -101.58 165.13 11.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.972 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.875 HG21 HD21 ' A' ' 88' ' ' LEU . 4.1 pt -62.97 144.01 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.147 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.6 m -110.29 106.85 16.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 101.83 10.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.552 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.512 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.35 157.16 44.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.996 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -87.04 157.05 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -110.83 -178.09 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 p -120.64 37.22 4.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -90.42 -54.03 4.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.0 t80 68.5 -68.1 0.18 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.9 -65.26 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.07 -79.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.211 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.24 17.41 2.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.919 0.39 . . . . 0.0 111.434 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -176.64 141.83 0.4 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.909 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.426 ' H ' HD12 ' A' ' 42' ' ' ILE . . . 147.97 45.61 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.481 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.64 ' N ' HD12 ' A' ' 42' ' ' ILE . 2.5 mp -84.24 -72.37 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 110.866 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -132.1 -177.1 4.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.47 87.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -83.54 108.73 16.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.882 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -140.96 113.89 0.89 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.496 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.25 -95.74 1.42 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.51 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 m -158.24 102.93 1.79 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.869 0.366 . . . . 0.0 110.858 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 153.1 49.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.495 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.18 32.99 2.36 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.534 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -132.17 82.37 2.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.895 0.379 . . . . 0.0 110.911 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -60.87 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -172.12 47.34 0.18 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.548 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.15 172.1 19.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.95 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 101.51 -174.64 24.98 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.458 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.27 93.39 1.03 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.487 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.98 87.41 51.77 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.767 0.318 . . . . 0.0 110.888 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -51.72 164.7 0.91 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.554 2.169 . . . . 0.0 112.293 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 59.31 31.2 20.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.445 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -109.79 135.0 20.46 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.445 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.56 125.95 18.66 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.379 2.053 . . . . 0.0 112.144 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.54 139.34 30.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.9 p -57.73 164.22 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.3 114.67 23.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.44 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.45 -75.04 0.38 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.607 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.2 p -98.78 152.33 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 110.941 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 87.25 1.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.02 136.85 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.4 p-80 -73.76 151.48 40.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.972 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.541 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -79.69 153.51 4.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.908 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.521 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.41 35.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -109.3 163.05 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -77.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.42 120.57 22.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.9 mm -122.83 154.02 27.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.6 mp -112.2 106.83 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.369 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -90.85 129.39 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.967 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -161.41 162.78 30.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.182 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.658 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 55.01 36.13 26.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.14 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 62.5 30.19 17.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.012 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -164.03 170.11 17.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 30.8 p-80 -88.38 120.94 30.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.682 ' CB ' HD13 ' A' ' 88' ' ' LEU . 47.4 m95 -110.17 130.04 55.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.541 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.54 174.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.7 t -79.99 -42.17 24.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -90.35 -29.75 17.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.956 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.6 m -69.63 -31.41 69.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.875 HD21 HG21 ' A' ' 28' ' ' ILE . 7.3 tp -72.82 77.52 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -137.05 165.46 25.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.809 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.59 147.07 39.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -28.49 67.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.013 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -111.49 -57.24 2.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 26.9 m -57.76 -46.1 85.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.067 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 94' ' ' HIS . 10.5 t-160 58.31 21.7 8.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.538 ' O ' HD13 ' A' ' 97' ' ' LEU . 13.3 m -86.47 155.69 56.74 Favored Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.118 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 118.98 5.95 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.495 2.13 . . . . 0.0 112.081 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 88' ' ' LEU . 7.4 mp -107.59 64.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.805 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -100.04 30.66 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.112 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.78 ' N ' HD11 ' A' ' 28' ' ' ILE . 15.3 mm-40 -138.48 -47.23 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.676 ' CB ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -153.58 148.12 26.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.816 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.634 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.5 t -143.2 128.24 18.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.438 ' CD1' ' HG3' ' A' ' 111' ' ' LYS . 0.6 OUTLIER -111.52 172.03 7.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.807 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 p -152.24 122.72 7.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.946 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.13 124.06 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.13 -102.02 2.01 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.495 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -143.56 34.92 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -153.33 152.46 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.436 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.9 p -77.98 124.47 36.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -121.01 143.31 49.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.002 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.0 p -87.91 153.54 21.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.438 ' HG3' ' CD1' ' A' ' 102' ' ' PHE . 29.6 mtpt -56.21 -34.69 66.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.927 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.403 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 5.5 t0 -63.43 -28.05 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -83.91 -22.95 31.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.202 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.516 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 8.8 t80 -73.86 -49.81 23.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.029 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.524 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 m-85 -51.88 -40.23 60.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.853 0.359 . . . . 0.0 111.239 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -85.07 -64.11 1.21 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.465 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -59.91 -49.27 78.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.58 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -109.26 37.02 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -164.39 168.1 38.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.6 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' HG11 ' A' ' 142' ' ' VAL . 85.8 m -61.55 154.99 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.69 0.281 . . . . 0.0 110.659 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -162.11 161.15 28.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 111.168 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.02 137.27 56.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.84 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.6 29.76 3.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -58.18 1.47 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.292 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 17.1 p -110.85 8.15 22.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.46 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 59.51 29.44 19.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.697 0.284 . . . . 0.0 111.069 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 tp -92.18 121.69 33.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.48 112.08 3.42 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.763 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.781 HG22 HD11 ' A' ' 15' ' ' LEU . 4.2 mt -71.77 132.92 84.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 76.1 Cg_exo -47.37 176.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.297 1.998 . . . . 0.0 112.592 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.03 -52.13 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.113 2.542 . . . . 0.0 113.632 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.9 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.03 22.02 7.39 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.092 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -55.88 -169.94 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.678 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.806 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -120.14 108.81 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.019 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.779 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.1 p -157.05 160.93 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.942 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.61 134.87 39.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.487 179.743 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.401 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -112.14 135.87 52.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.878 -179.642 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.829 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -71.21 96.67 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.977 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.65 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.359 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 138' ' ' ALA . 3.2 t70 -90.55 -46.07 8.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.782 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.644 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.462 HG11 ' CG2' ' A' ' 120' ' ' THR . 10.5 p -117.1 150.61 19.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.679 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.484 ' O ' HG21 ' A' ' 135' ' ' VAL . 27.5 m-85 -132.16 174.95 9.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.443 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -79.43 165.24 23.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.913 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.806 HD21 ' O ' ' A' ' 134' ' ' VAL . 3.3 mp -81.07 -32.32 34.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -91.36 -49.29 6.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.727 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.443 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 69.3 m -53.55 -29.6 37.71 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.127 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.788 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.89 114.68 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.086 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.529 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.19 154.24 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.035 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.56 149.96 28.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 152' ' ' VAL . 5.1 m -63.9 -28.22 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.402 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 151' ' ' VAL . 19.7 t -109.07 -56.7 4.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.338 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 31.7 m -65.92 -28.13 68.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.172 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.529 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 68.5 mttt 49.93 48.57 21.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.072 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -118.35 136.66 53.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.026 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.2 149.51 19.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.319 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.712 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.6 OUTLIER -114.9 162.26 17.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.499 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 172.56 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 3.5 m -45.43 125.34 5.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.398 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.87 -22.76 37.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.694 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.461 ' C ' HG23 ' A' ' 9' ' ' VAL . 10.1 t70 -62.19 128.9 38.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 110.765 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 9' ' ' VAL . 56.5 mt-10 -87.98 123.42 32.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.94 0.4 . . . . 0.0 111.098 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.891 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -144.0 156.4 44.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.705 ' HB2' HG13 ' A' ' 172' ' ' VAL . 47.4 m-85 -108.62 171.1 7.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.829 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -125.31 121.34 33.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.853 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 6.7 mmt -81.6 166.97 19.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -65.86 -28.43 68.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -97.68 29.23 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.2 57.04 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.468 ' HB3' HG11 ' A' ' 151' ' ' VAL . 4.6 mtt180 -125.66 128.29 47.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' A' ' 163' ' ' PHE . 3.0 mp -78.6 133.29 37.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.705 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.5 p -145.06 137.27 21.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.935 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.6 p -81.56 169.13 17.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -59.13 -51.79 68.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.6 -25.47 52.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.293 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -96.81 -14.54 21.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.381 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.401 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 7.2 t80 -57.58 -66.0 0.54 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.371 . . . . 0.0 110.911 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.36 -28.49 70.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.139 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.9 m -75.33 -33.3 61.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.062 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -88.9 -49.58 6.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.216 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm 62.34 175.36 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.927 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.933 179.99 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.766 0.317 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.06 161.02 28.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -176.49 -40.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.661 HG21 HG12 ' A' ' 7' ' ' VAL . 12.2 m -87.49 148.66 44.81 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.12 -45.81 0.82 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.521 2.148 . . . . 0.0 112.286 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -176.43 78.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.661 HG12 HG21 ' A' ' 4' ' ' VAL . 13.2 p -100.53 158.89 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.164 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.498 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -157.21 -170.61 3.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.667 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.5 p -155.04 147.59 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 157' ' ' LEU . 22.5 t -61.85 146.31 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.652 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.4 -163.54 10.49 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.521 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.69 130.04 84.26 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.449 0.166 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.892 ' HB2' HG12 ' A' ' 134' ' ' VAL . 25.2 Cg_exo -60.67 146.91 96.37 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.269 1.979 . . . . 0.0 112.399 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.13 160.56 24.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.465 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -144.02 173.58 11.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.066 0.46 . . . . 0.0 111.36 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -39.85 94.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.896 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.39 83.02 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.642 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.34 -126.01 3.24 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.32 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 170.51 -33.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 110.826 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 3.4 t80 69.18 161.67 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.869 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -111.02 127.14 8.1 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.627 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.575 ' OD1' HD11 ' A' ' 27' ' ' LEU . 9.5 t0 -84.05 -30.42 26.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.875 0.369 . . . . 0.0 110.936 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -58.07 -24.51 58.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.114 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.66 -30.13 54.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.06 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.446 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.9 OUTLIER -109.14 175.99 5.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.908 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.7 mmt85 -94.38 99.97 12.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.4 mm? -69.96 161.34 30.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.864 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.783 HG23 ' HB2' ' A' ' 101' ' ' CYS . 6.2 pt -62.99 138.52 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 m -100.52 106.84 18.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.2 mtm-85 -84.69 101.73 12.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.377 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -133.74 151.43 51.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.88 96.97 3.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.408 ' OD1' HD13 ' A' ' 31' ' ' LEU . 1.8 m120 -68.34 116.15 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -65.59 79.22 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -151.8 78.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -96.02 -31.49 13.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -127.42 115.66 19.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -165.11 -43.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.125 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.27 107.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.068 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.24 34.99 20.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.34 -57.29 2.38 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.45 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 43' ' ' ASP . 42.2 mm -82.03 154.17 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.847 0.356 . . . . 0.0 110.917 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.4 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER 60.55 157.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.36 157.73 16.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -99.17 117.2 33.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 164.58 55.26 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.454 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 178.43 -148.44 8.44 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.515 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 94.5 p -176.5 126.63 0.18 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 110.897 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -140.64 31.72 2.2 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.547 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 137.44 -111.04 0.8 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.49 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -105.5 -56.64 2.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.6 mmt 60.54 176.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 137.53 -178.13 19.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.465 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.58 -67.79 0.44 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.772 0.32 . . . . 0.0 110.895 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 137.59 -150.3 20.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.518 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -145.04 151.62 23.77 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.44 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.07 86.12 55.34 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.688 0.28 . . . . 0.0 110.851 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.37 164.07 35.56 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.562 2.175 . . . . 0.0 112.209 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 59.08 31.61 21.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.857 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.4 tp -106.56 134.7 19.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.112 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.438 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.9 Cg_endo -61.17 125.99 18.33 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.388 2.059 . . . . 0.0 112.084 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.9 139.81 30.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.069 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.7 p -57.54 164.14 2.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.958 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.42 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.31 114.61 23.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.481 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.06 -71.36 0.44 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.601 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.8 p -103.56 152.94 21.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.774 0.321 . . . . 0.0 110.981 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.45 87.2 2.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.11 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -178.79 135.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.704 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.0 p-80 -71.39 143.47 50.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 70' ' ' ILE . 3.4 mm -68.76 147.62 12.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.704 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.7 35.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.929 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' HD11 ' A' ' 75' ' ' ILE . 2.0 m-20 -111.39 144.6 40.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.91 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -34.26 67.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.109 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.585 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.0 m-85 -106.19 112.03 24.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.585 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.6 mm -132.61 147.48 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -109.82 107.35 17.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.286 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -90.77 122.5 33.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.055 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.778 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -164.71 167.1 19.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.8 mt 62.95 37.04 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 29.18 17.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.065 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -170.62 -179.56 2.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.1 p80 -97.99 124.45 42.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.972 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.776 ' CB ' HD13 ' A' ' 88' ' ' LEU . 42.2 m95 -116.54 130.8 56.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.779 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.71 172.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p -79.57 -40.62 29.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -91.0 -28.47 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.54 -31.15 68.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.993 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.776 HD13 ' CB ' ' A' ' 83' ' ' TRP . 5.2 tp -80.86 94.38 6.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.976 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -144.07 156.77 44.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 23.7 t -60.0 147.13 40.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.805 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.3 m -74.21 -28.88 61.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.173 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -101.39 -63.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.135 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.468 ' HB2' HG22 ' A' ' 95' ' ' VAL . 37.2 m -60.07 -30.69 69.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.097 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 57.31 23.18 8.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.468 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.0 m -85.81 156.31 58.38 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.247 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.57 118.93 5.96 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.525 2.15 . . . . 0.0 112.297 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -103.8 86.69 2.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -114.84 30.5 7.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.092 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.7 ' C ' HD11 ' A' ' 28' ' ' ILE . 41.2 mt-10 -140.03 -47.37 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.619 ' CB ' HD12 ' A' ' 27' ' ' LEU . 1.9 mpp_? -150.81 146.46 26.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.811 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.783 ' HB2' HG23 ' A' ' 28' ' ' ILE . 14.5 t -126.13 158.92 34.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.446 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.62 119.98 5.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 79' ' ' LEU . 17.8 p -139.11 150.86 46.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.24 124.0 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.828 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -114.4 4.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.535 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -123.87 32.99 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 0.0 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.2 m -157.69 166.89 31.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.541 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.5 p -129.33 115.98 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.077 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.2 OUTLIER -131.7 132.42 43.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -52.06 167.02 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 115' ' ' PHE . 1.7 mtmt -67.19 -30.43 70.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 4.8 t70 -55.2 -48.86 73.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -72.23 -20.9 61.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.051 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 118' ' ' PHE . 10.4 t80 -66.4 -41.05 89.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.951 0.405 . . . . 0.0 110.809 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.4 m-85 -67.77 -26.16 65.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.944 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -43.81 25.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.21 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 118' ' ' PHE . 14.4 ptp180 -79.27 -47.24 16.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.382 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 114' ' ' PHE . 76.3 m-85 -84.52 -43.02 14.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.99 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.94 167.89 40.57 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.574 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.8 m -59.58 152.93 20.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.6 172.24 14.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.069 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.2 t -63.77 138.57 58.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.71 29.53 2.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.995 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.22 -58.13 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.963 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 16.3 p -108.24 12.66 26.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.289 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 54.12 30.0 11.33 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.87 0.367 . . . . 0.0 111.083 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 144' ' ' HIS . 18.6 tp -94.1 138.65 31.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.909 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -65.4 130.79 34.98 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.688 HG22 HD11 ' A' ' 15' ' ' LEU . 22.3 mt -87.0 126.82 61.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.435 0.159 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.636 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 86.0 Cg_exo -44.43 173.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.72 2.28 . . . . 0.0 112.706 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.87 -55.12 0.22 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.866 2.377 . . . . 0.0 113.684 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.896 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.2 21.42 7.36 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.296 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.636 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.0 OUTLIER -59.02 138.54 57.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.388 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.892 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.0 OUTLIER -78.14 108.64 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.988 0.423 . . . . 0.0 110.891 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.754 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.9 p -143.12 161.04 17.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.951 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.664 ' HD3' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -96.78 134.98 39.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.929 0.395 . . . . 0.0 110.822 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.19 157.89 16.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.956 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.759 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -100.6 96.75 7.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.756 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.475 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.38 -86.52 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.497 0.665 . . . . 0.0 111.821 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -100.22 -48.97 4.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.783 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -82.59 161.78 22.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.628 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.471 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.6 p -106.31 151.28 8.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.672 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.521 ' O ' HG21 ' A' ' 135' ' ' VAL . 19.5 m-85 -129.68 174.97 9.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.036 0.446 . . . . 0.0 111.394 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -78.0 160.73 27.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.773 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.664 HD12 ' HD3' ' A' ' 136' ' ' ARG . 16.3 tp -81.03 -31.3 34.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.857 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -91.27 -49.28 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.913 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.3 m -53.35 -30.14 37.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.231 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.725 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 1.3 t80 -56.84 116.16 3.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.099 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.16 -177.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.926 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.0 t -99.88 150.04 22.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.62 HG11 ' HG2' ' A' ' 170' ' ' ARG . 6.0 m -65.91 -26.37 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.314 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.616 HG23 HG23 ' A' ' 151' ' ' VAL . 25.7 t -107.89 -55.76 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.371 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.01 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 53.9 34.98 20.65 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.159 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -124.68 143.93 50.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.435 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.3 mt-30 -59.01 154.06 16.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.6 mm? -111.77 123.05 49.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -99.25 158.18 15.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.7 t -44.84 132.48 6.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.534 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 106.81 -32.38 7.32 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.548 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.513 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -71.02 133.61 46.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.834 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -87.97 116.12 25.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.027 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.814 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -126.5 144.65 50.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 5.0 m-85 -96.97 147.39 24.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.759 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -106.53 110.94 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.6 mmt -72.52 150.01 43.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -59.36 -28.76 67.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.012 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -97.48 36.2 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.996 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 3.1 p 49.97 83.6 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.184 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.62 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.7 OUTLIER -156.43 120.38 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.814 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -80.12 126.5 31.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.09 127.87 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 52.6 m -58.34 -173.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HE3' ' CE2' ' A' ' 164' ' ' TYR . 0.1 OUTLIER -72.8 -49.59 29.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -68.2 -44.12 76.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.119 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -58.81 -23.61 60.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.37 -65.97 0.5 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.46 -27.89 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.14 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.3 m -78.56 -30.44 46.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.065 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.88 16.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.257 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm 61.32 175.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.797 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.92 179.993 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.886 0.374 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.3 t -81.6 122.23 27.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.856 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.518 ' O ' HG13 ' A' ' 4' ' ' VAL . 4.9 pt20 -60.75 173.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.518 HG13 ' O ' ' A' ' 3' ' ' GLN . 6.1 m -158.88 87.0 2.25 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.051 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.96 143.75 50.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.561 2.174 . . . . 0.0 112.33 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -176.09 -171.62 0.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p -58.37 142.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.895 0.378 . . . . 0.0 111.21 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.504 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -158.08 -175.87 5.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.527 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.463 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.0 p -155.03 131.82 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.185 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.473 HG23 ' CD1' ' A' ' 163' ' ' PHE . 57.8 t -55.71 146.3 5.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.667 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.501 ' C ' HG23 ' A' ' 159' ' ' THR . . . -127.5 -161.42 10.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.513 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -61.68 139.46 95.3 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.512 0.196 . . . . 0.0 110.759 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.3 Cg_exo -77.69 132.66 12.2 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.572 2.181 . . . . 0.0 112.193 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.02 155.74 25.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.2 mt -131.6 173.53 11.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.175 0.512 . . . . 0.0 111.525 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.527 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.6 -32.14 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.745 179.721 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.958 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.59 58.57 13.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.531 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -91.49 -75.34 1.3 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.563 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 65.56 77.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.478 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.8 OUTLIER -57.89 -170.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.65 -163.28 34.46 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.541 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -84.0 -31.84 25.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.753 0.311 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -59.58 -26.75 65.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.051 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.23 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.03 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 13.0 mm-40 -103.28 175.25 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.966 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -84.15 134.32 34.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.857 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 100' ' ' ARG . 3.0 mm? -95.43 165.01 12.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.969 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.691 HG23 ' HB2' ' A' ' 101' ' ' CYS . 9.4 pt -62.91 134.91 27.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.166 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -95.16 106.89 18.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.967 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.21 101.76 6.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.414 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.07 154.19 43.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -79.01 156.99 28.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -115.25 116.62 28.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.537 HG23 ' O ' ' A' ' 34' ' ' THR . 6.5 t -75.19 89.52 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.891 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.449 ' NE2' ' O ' ' A' ' 34' ' ' THR . 4.2 mp0 -149.07 -73.43 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 68.13 -69.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.994 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.28 107.65 5.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.69 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -172.79 93.08 0.11 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.07 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.15 -171.29 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.061 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -60.42 94.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.862 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -104.15 -98.69 2.52 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.6 144.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.816 0.341 . . . . 0.0 111.408 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -70.59 117.73 12.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -148.87 -47.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.842 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.66 127.69 32.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.49 56.99 0.69 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.527 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.55 -137.08 13.18 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -155.91 160.68 40.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -157.08 -46.91 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.462 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.98 89.72 0.18 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.511 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -153.07 98.77 2.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.866 0.365 . . . . 0.0 110.881 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.5 31.32 3.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -166.41 109.88 0.38 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.575 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.0 p -157.66 156.4 31.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.919 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -172.05 114.85 0.54 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.477 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.67 -160.75 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.49 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.94 89.46 2.4 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.647 0.26 . . . . 0.0 110.895 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.27 165.14 27.79 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.489 2.126 . . . . 0.0 112.146 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 58.66 30.03 19.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.794 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.508 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -103.57 135.33 19.39 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.431 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.1 Cg_endo -60.92 125.96 18.43 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.35 2.034 . . . . 0.0 112.062 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.99 163.55 22.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.088 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.3 t -73.82 154.71 39.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.575 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.55 114.65 21.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.498 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.65 -50.03 0.81 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.453 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.5 p -108.64 -179.0 3.74 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.847 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -108.0 75.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.012 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.25 132.5 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.508 ' CD2' HG21 ' A' ' 60' ' ' ILE . 9.3 p80 -63.85 134.84 55.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.491 ' HA ' HD13 ' A' ' 70' ' ' ILE . 4.7 mm -59.65 151.54 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.937 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.69 HD22 ' O ' ' A' ' 38' ' ' ALA . 0.6 OUTLIER -174.58 36.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.873 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -107.16 158.23 17.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -60.13 -74.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.6 121.15 24.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.995 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.2 mm -124.86 151.49 30.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.205 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 mp -109.74 106.98 16.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.392 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -90.75 124.38 35.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -159.04 159.9 35.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.13 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.834 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.9 OUTLIER 58.31 36.44 25.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.44 32.7 16.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.04 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 mtm-85 -170.02 169.93 7.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -86.42 127.41 34.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.623 ' CB ' HD13 ' A' ' 88' ' ' LEU . 53.5 m95 -119.81 123.71 44.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.8 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.78 172.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.992 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -77.11 -47.8 19.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.855 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -85.91 -25.81 25.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 84.5 m -73.82 -28.2 61.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.775 HD23 ' O ' ' A' ' 97' ' ' LEU . 15.9 tp -80.79 90.17 5.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.002 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -143.71 154.83 43.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 8.4 t -59.85 147.06 39.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.847 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.4 m -73.51 -28.78 62.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.154 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -101.43 -63.05 1.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.189 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.525 ' HB2' HG22 ' A' ' 95' ' ' VAL . 30.0 m -59.83 -29.8 68.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.66 22.72 8.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.015 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.525 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.2 m -84.81 156.47 61.2 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.138 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.98 5.92 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.534 2.156 . . . . 0.0 112.366 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.775 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.1 mp -104.88 61.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.828 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.32 40.51 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.575 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.9 mm-40 -151.7 -46.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.693 ' HB3' HD12 ' A' ' 27' ' ' LEU . 40.6 mtm180 -148.23 143.61 27.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.834 ' SG ' HD21 ' A' ' 79' ' ' LEU . 51.3 t -119.16 156.05 30.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.99 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.444 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.82 119.97 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.775 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.408 ' HB2' HD22 ' A' ' 79' ' ' LEU . 1.2 t -96.73 160.53 14.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.448 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 0.0 OUTLIER -164.67 123.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.52 -131.86 51.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -98.85 31.62 2.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.885 0.374 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.3 m -162.66 173.73 13.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.797 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.546 HG13 ' O ' ' A' ' 108' ' ' VAL . 13.8 p -102.15 115.86 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.35 120.94 36.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.857 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.1 p -60.33 172.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.13 -32.19 50.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.773 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.443 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -51.74 -57.99 7.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.424 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -74.15 -20.67 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.478 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 t80 -62.19 -26.36 68.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.94 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.443 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 3.7 m-85 -78.97 -39.61 33.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.036 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -85.04 -51.03 6.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.253 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 -73.35 -51.35 17.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.448 ' CE2' ' CD ' ' A' ' 104' ' ' ARG . 5.1 m-85 -102.79 37.04 2.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.108 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.65 162.96 32.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.449 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.48 ' CG2' HG11 ' A' ' 142' ' ' VAL . 74.8 m -58.76 152.16 19.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.761 0.315 . . . . 0.0 110.959 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 126' ' ' GLN . 0.1 OUTLIER -169.01 147.88 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.449 ' N ' HD11 ' A' ' 129' ' ' ILE . 38.0 t -65.44 130.84 44.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.922 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -95.67 23.45 6.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -41.61 2.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.978 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.9 m -106.94 -12.9 15.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.293 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER 63.95 30.27 14.23 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 0.0 110.784 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.411 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.9 tp -106.61 137.65 44.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.61 102.28 0.8 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.646 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.485 ' CD1' HG13 ' A' ' 142' ' ' VAL . 6.7 mt -60.26 140.38 91.39 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.493 0.187 . . . . 0.0 110.801 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.626 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 84.1 Cg_exo -47.34 173.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.468 2.112 . . . . 0.0 112.31 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.39 -54.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.47 2.113 . . . . 0.0 113.85 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.958 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -121.88 21.59 10.63 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.0 OUTLIER -59.02 140.01 56.21 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.512 179.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.732 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -80.12 108.74 13.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.934 0.397 . . . . 0.0 110.727 -179.862 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.2 p -154.64 158.91 3.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.218 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -96.91 137.98 35.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.653 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.85 131.09 54.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.768 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.583 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -59.76 96.53 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.662 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.506 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.5 OUTLIER 54.03 -86.47 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.391 0.615 . . . . 0.0 111.61 -179.69 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.9 m-20 -99.42 -48.47 4.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -80.63 166.59 20.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.585 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.485 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.7 p -127.15 157.24 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.647 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.583 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 22.7 m-85 -153.58 161.79 41.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.4 . . . . 0.0 111.324 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 77.0 m80 -60.62 145.4 49.15 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.308 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.511 ' CD2' HG23 ' A' ' 135' ' ' VAL . 0.3 OUTLIER -66.76 -17.95 65.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -81.94 -49.02 10.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.946 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 15.1 p -81.06 -29.87 34.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.172 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.672 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 20.0 t80 -63.08 99.07 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.84 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' A' ' 155' ' ' ARG . . . -162.0 175.28 11.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.098 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 47.1 t -78.72 150.21 32.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.723 HG11 ' NH1' ' A' ' 170' ' ' ARG . 34.5 m -72.26 -39.82 64.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.419 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.704 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -83.45 -57.23 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.549 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 35.2 m -65.89 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.9 34.36 23.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ARG . . . . . 0.553 ' O ' ' HB1' ' A' ' 149' ' ' ALA . 54.0 mtm-85 -128.98 151.41 49.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -75.71 150.42 37.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.948 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.694 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.2 mm? -100.88 171.49 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.811 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.03 167.18 23.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.938 0.399 . . . . 0.0 111.275 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.501 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.2 m -43.27 129.14 4.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.644 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.19 -22.94 33.95 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.828 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.463 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.8 t0 -67.94 129.03 38.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.86 0.362 . . . . 0.0 110.81 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.427 ' HA ' HG23 ' A' ' 9' ' ' VAL . 32.2 mt-10 -88.02 123.64 32.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.033 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.58 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.3 p90 -141.45 162.39 35.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.072 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.539 ' HB2' HG13 ' A' ' 172' ' ' VAL . 50.9 m-85 -110.93 171.03 7.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.908 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.506 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.1 tp -131.77 110.97 11.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.9 mmt -73.53 -89.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.137 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -83.2 -49.2 9.69 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.84 0.352 . . . . 0.0 110.963 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -173.91 -59.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.675 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.411 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . 32.8 t -93.3 -22.99 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.723 ' NH1' HG11 ' A' ' 151' ' ' VAL . 2.9 mmm180 -56.41 102.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.13 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.672 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -91.51 125.77 36.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.826 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.656 HG23 ' OD2' ' A' ' 176' ' ' ASP . 11.8 p -145.03 123.36 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.066 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 5.1 m -66.76 -172.44 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.056 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.423 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 1.4 mtpm? -86.08 -35.99 19.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.776 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.59 67.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.091 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.704 ' HB2' HG21 ' A' ' 152' ' ' VAL . 3.8 p-10 -85.07 4.09 35.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.457 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 21.7 t80 -62.01 -65.98 0.61 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.059 0.457 . . . . 0.0 110.978 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -47.02 -28.63 1.74 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.492 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -30.57 57.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.975 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.06 -20.78 17.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.526 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.46 -178.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.816 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.8 p . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.831 0.348 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 p -66.36 131.5 46.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.87 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -131.31 123.25 27.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.907 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.56 HG12 ' CG1' ' A' ' 7' ' ' VAL . 12.3 m -154.75 84.18 3.84 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.095 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.71 -43.3 1.93 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.589 2.193 . . . . 0.0 112.293 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -157.55 54.26 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.618 HG11 ' HE2' ' A' ' 174' ' ' LYS . 14.6 p -124.45 159.48 30.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.256 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -109.27 -165.37 1.01 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.363 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.536 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.4 p -155.06 144.7 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 0.0 111.369 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.445 HG13 ' HG3' ' A' ' 136' ' ' ARG . 47.8 t -62.06 146.1 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.169 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.68 -159.37 10.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.949 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -68.2 132.83 91.64 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.481 0.181 . . . . 0.0 110.9 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -65.25 145.15 83.25 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.343 2.029 . . . . 0.0 112.567 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.06 142.97 5.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.226 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -124.22 173.67 8.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.942 0.401 . . . . 0.0 111.28 -179.544 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.732 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -72.04 -39.17 69.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.132 -179.823 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 53.04 82.32 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.6 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.31 -51.31 0.25 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.532 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 62.45 -176.09 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 0.0 110.8 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.487 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -156.42 -75.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.64 144.73 14.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.596 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.512 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.8 p-10 -82.41 -30.97 29.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.02 -25.9 63.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.223 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -55.99 -68.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.131 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HG2' ' CE1' ' A' ' 102' ' ' PHE . 3.1 tp10 -75.64 173.45 11.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.02 100.0 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.852 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.696 HD11 ' CB ' ' A' ' 100' ' ' ARG . 2.5 tp -77.22 159.0 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.038 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.4 pt -62.95 127.58 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 m -88.11 106.84 18.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.799 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.08 101.83 11.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -146.09 153.37 40.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.991 -179.747 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -82.2 157.0 24.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -111.39 113.85 26.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.925 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.567 HG23 ' O ' ' A' ' 34' ' ' THR . 7.8 t -70.68 84.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -137.31 -74.77 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.955 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.97 -70.08 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.39 105.61 17.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.923 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.27 -46.63 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.081 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.507 ' HB3' ' CD1' ' A' ' 71' ' ' LEU . . . -129.96 17.49 5.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.445 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 60.75 79.75 0.24 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.54 -29.9 76.25 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.511 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.64 153.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.822 0.344 . . . . 0.0 111.388 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -78.68 -62.15 1.78 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.25 129.12 54.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.54 163.34 12.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.911 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.48 -115.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.43 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -137.56 63.22 0.57 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.514 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.5 t -156.91 87.42 1.0 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.92 -32.5 0.16 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.509 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.67 -93.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.502 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -93.73 89.25 6.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.831 0.348 . . . . 0.0 110.923 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.6 mtt -131.42 161.32 32.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.877 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 136.25 -74.21 0.42 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.474 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.4 m -106.65 131.91 53.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.869 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.49 134.0 7.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.454 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -105.1 -160.67 23.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.494 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.597 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER -84.14 141.2 40.02 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.663 0.268 . . . . 0.0 110.897 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HD2' HG22 ' A' ' 57' ' ' THR . 60.8 Cg_endo -72.78 164.51 35.37 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.443 2.095 . . . . 0.0 112.262 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 57.09 28.51 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.554 HG21 ' ND1' ' A' ' 69' ' ' HIS . 3.4 tp -96.83 135.03 22.35 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.451 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.0 Cg_endo -58.55 125.94 19.86 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.431 2.087 . . . . 0.0 111.994 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 136.14 33.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -58.24 164.17 2.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.904 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.649 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -89.48 114.63 26.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.37 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 128.05 -68.37 0.54 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.538 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 11.7 p -108.43 141.98 39.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.51 83.91 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.015 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 179.57 126.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.554 ' ND1' HG21 ' A' ' 60' ' ' ILE . 26.1 p-80 -63.9 168.2 5.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.909 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.882 HD11 ' NE2' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -106.32 160.13 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.097 0.475 . . . . 0.0 110.818 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.507 ' CD1' ' HB3' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -173.21 35.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.292 179.697 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -99.24 -178.61 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.847 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -72.76 0.22 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.419 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -83.67 144.14 29.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.419 HD13 ' O ' ' A' ' 74' ' ' PHE . 37.0 mm -145.44 146.91 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.993 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -108.63 106.81 17.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.412 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -91.05 134.73 34.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -167.6 164.28 14.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.798 HD12 ' CE2' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 58.88 37.46 24.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.08 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.61 28.79 17.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -166.03 176.14 7.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.882 ' NE2' HD11 ' A' ' 70' ' ' ILE . 21.8 p-80 -94.09 128.8 40.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.798 ' CE2' HD12 ' A' ' 79' ' ' LEU . 42.2 m95 -119.64 133.2 55.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.725 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 171.72 0.27 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 t -80.05 -39.76 29.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.3 pttt -90.95 -29.08 17.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.13 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -67.65 -30.76 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.953 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.591 HD21 HG21 ' A' ' 28' ' ' ILE . 5.4 tp -68.43 75.8 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -120.73 136.82 54.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.841 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.26 135.3 57.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.4 m -80.1 -0.89 37.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.681 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 6.3 t0 -107.78 -63.02 1.36 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.716 0.293 . . . . 0.0 111.356 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.483 ' SG ' HG23 ' A' ' 95' ' ' VAL . 30.2 p -94.14 -21.09 19.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.456 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 59.11 39.76 22.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.9 0.381 . . . . 0.0 110.853 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.483 HG23 ' SG ' ' A' ' 93' ' ' CYS . 22.0 t -107.84 129.71 23.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.1 118.89 3.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.568 2.179 . . . . 0.0 112.479 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.677 HD23 ' O ' ' A' ' 100' ' ' ARG . 8.5 mp -85.18 -75.39 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.75 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 57.38 31.82 20.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.238 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.453 ' N ' HD11 ' A' ' 28' ' ' ILE . 6.4 mm-40 -156.45 -75.91 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.924 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.696 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -119.4 130.44 55.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.957 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.731 ' HB2' HG23 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -121.95 128.0 51.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.931 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.416 ' CE1' ' HG2' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -114.72 155.82 25.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.851 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.9 t -133.21 136.19 45.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.987 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -153.91 123.95 6.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.72 -60.58 4.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -176.54 -43.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 0.0 110.937 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 12.9 m -73.35 -170.77 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.0 p -113.03 122.91 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.06 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 92' ' ' ASP . 2.0 m-85 -119.26 155.79 31.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -102.39 149.24 24.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.706 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 2.5 mtmp? -54.57 -40.04 68.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.194 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -59.12 -29.53 67.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.923 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -84.12 -29.75 26.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.487 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 14.3 t80 -64.94 -30.22 71.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 3.5 m-85 -77.21 -41.22 42.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -81.35 -28.01 34.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 38.3 mmt180 -96.04 -55.47 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.22 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.451 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 12.4 m-85 -104.08 29.66 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.195 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.73 -151.14 5.7 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.278 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.732 HG21 ' SD ' ' A' ' 16' ' ' MET . 1.7 m -103.01 153.49 20.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.8 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -144.85 -164.99 2.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.958 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 32.4 t -116.5 139.05 50.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.958 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -104.96 24.97 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.28 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.434 ' HB2' ' CD1' ' A' ' 143' ' ' TYR . . . -125.13 -53.13 1.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.976 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.21 -16.57 13.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.247 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.8 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.2 tt0 71.14 79.45 0.17 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.831 0.348 . . . . 0.0 111.01 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.8 HD12 ' O ' ' A' ' 126' ' ' GLN . 0.4 OUTLIER -156.72 133.82 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.646 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.34 99.83 0.11 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.726 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.612 HG23 ' HD2' ' A' ' 130' ' ' PRO . 59.0 mt -62.49 141.54 96.62 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.548 0.214 . . . . 0.0 110.769 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HD2' HG23 ' A' ' 129' ' ' ILE . 78.6 Cg_exo -42.83 168.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.736 2.291 . . . . 0.0 112.772 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -77.14 -55.64 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.926 2.417 . . . . 0.0 114.737 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.478 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 2.0 m -126.43 21.96 7.13 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -177.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 71.2 mm-40 -58.17 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.322 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.799 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -129.13 108.61 17.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.738 0.304 . . . . 0.0 111.112 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.4 p -143.49 157.68 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.74 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.476 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.48 134.96 39.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.064 0.459 . . . . 0.0 111.252 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.0 172.97 6.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.528 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -146.31 168.97 19.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.229 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.683 ' HG3' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 40.73 -83.82 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.55 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' A' ' 138' ' ' ALA . 21.7 t0 -162.09 38.12 0.12 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.732 0.301 . . . . 0.0 111.19 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.404 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . 0.6 OUTLIER -153.43 157.17 39.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.698 179.717 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.606 HG13 HD12 ' A' ' 129' ' ' ILE . 11.6 p -109.67 153.18 11.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.668 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.655 ' OH ' HD11 ' A' ' 165' ' ' LEU . 14.6 m-85 -143.47 147.54 34.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.023 0.44 . . . . 0.0 111.35 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 77.8 m80 -57.84 143.68 41.52 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.37 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.799 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -65.05 -17.93 64.87 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 176.761 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -82.53 -41.06 20.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.222 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.41 -25.79 20.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.636 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.542 ' CE1' HD21 ' A' ' 171' ' ' LEU . 2.1 t80 -60.54 91.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.84 0.352 . . . . 0.0 110.657 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.548 ' HB1' ' C ' ' A' ' 155' ' ' ARG . . . -167.78 174.25 7.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 49.5 t -76.23 150.25 37.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.612 HG11 ' CG ' ' A' ' 170' ' ' ARG . 6.4 m -74.89 -35.56 36.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.345 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.51 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -88.75 -57.55 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.412 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.8 m -65.86 -28.09 68.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.157 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt 60.31 38.72 19.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ARG . . . . . 0.548 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 22.4 ttm-85 -128.96 145.14 51.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.028 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -78.29 155.94 29.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.028 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.705 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -106.46 168.72 8.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.675 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.04 166.94 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.315 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.5 m -43.37 122.04 2.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.539 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.73 -23.94 31.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.614 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.536 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.9 t0 -77.29 129.0 35.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.848 0.356 . . . . 0.0 110.88 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 33.3 mt-10 -87.98 121.65 30.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.941 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.651 ' CD2' HD23 ' A' ' 171' ' ' LEU . 17.8 p90 -131.07 179.04 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CZ ' ' HB ' ' A' ' 7' ' ' VAL . 0.7 OUTLIER -132.63 114.91 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.525 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.683 HD22 ' HG3' ' A' ' 139' ' ' GLN . 7.7 tt -93.73 110.81 22.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 0.0 110.51 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.19 159.95 33.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.76 -25.57 7.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.89 27.61 3.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.188 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 5.0 m 55.45 31.19 16.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.024 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.612 ' CG ' HG11 ' A' ' 151' ' ' VAL . 14.9 ttm180 -94.72 102.84 14.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -66.97 126.77 30.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.898 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.647 HG23 ' OD2' ' A' ' 176' ' ' ASP . 8.6 p -145.34 140.73 22.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.711 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.9 155.09 23.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.775 0.321 . . . . 0.0 110.963 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.618 ' HE2' HG11 ' A' ' 7' ' ' VAL . 8.7 mtmt -60.51 -30.16 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.769 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.35 -59.07 5.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.272 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.647 ' OD2' HG23 ' A' ' 172' ' ' VAL . 4.8 p-10 -81.39 -0.18 40.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.404 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.457 ' CZ ' ' HE2' ' A' ' 181' ' ' LYS . 8.7 t80 -61.67 -65.74 0.64 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.939 0.399 . . . . 0.0 110.657 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -57.21 -26.77 61.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.128 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 59.0 m -75.4 -22.84 57.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.339 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' ALA . . . . . 0.529 ' HB3' ' HZ3' ' A' ' 181' ' ' LYS . . . -97.01 -32.19 12.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' LYS . . . . . 0.529 ' HZ3' ' HB3' ' A' ' 180' ' ' ALA . 0.0 OUTLIER -171.93 -177.27 1.89 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.866 179.892 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.4 p . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.842 0.354 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 t -100.48 -46.96 5.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tm0? 62.37 149.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.5 m -118.4 82.64 19.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.088 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 166.11 29.39 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.625 2.217 . . . . 0.0 112.298 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 60.25 81.01 0.19 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.922 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 8' ' ' MET . 12.9 p -125.96 158.63 35.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.595 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -129.42 -175.04 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.723 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.519 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.6 p -154.98 134.48 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.16 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.443 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.0 t -58.15 146.12 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.46 -169.35 12.6 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.482 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -60.35 146.19 84.78 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.565 0.221 . . . . 0.0 110.687 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.876 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.4 Cg_exo -77.89 129.96 10.18 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.57 2.18 . . . . 0.0 112.238 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.75 154.61 35.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.441 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -138.73 173.72 11.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.143 0.497 . . . . 0.0 111.555 -179.631 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.444 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.69 -50.57 32.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.979 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.649 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 59.46 96.1 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.76 -66.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.562 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 60.79 95.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' CE1' ' A' ' 115' ' ' PHE . 11.0 p90 -58.71 -32.6 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.67 129.88 2.71 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.491 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.601 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.0 p30 -58.01 -28.38 64.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.737 0.304 . . . . 0.0 111.124 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -64.48 -51.13 64.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.114 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.43 -36.44 71.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.076 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.415 ' HG3' ' CE2' ' A' ' 102' ' ' PHE . 31.3 mm-40 -72.74 176.03 5.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.83 100.0 4.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.808 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -101.4 144.03 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.95 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.695 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.8 pt -63.01 148.15 11.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -118.02 106.88 13.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -77.23 101.86 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.642 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -138.49 160.22 40.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.018 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -74.3 119.63 18.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.45 -28.41 66.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.011 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m 63.48 34.14 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -130.53 76.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -98.66 31.41 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.924 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -152.15 78.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -156.42 -45.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.095 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB3' HD22 ' A' ' 71' ' ' LEU . . . -150.79 169.89 20.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.104 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -60.31 90.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.21 -154.1 25.77 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.509 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.502 HG23 ' N ' ' A' ' 43' ' ' ASP . 4.8 tp -52.25 -44.97 43.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.863 0.363 . . . . 0.0 111.519 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.502 ' N ' HG23 ' A' ' 42' ' ' ILE . 2.8 m-20 -60.78 149.88 34.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -133.05 129.94 38.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.855 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -79.98 -34.36 38.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.48 -46.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.503 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -153.24 140.16 7.4 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.487 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.9 p -176.25 -41.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.839 0.352 . . . . 0.0 110.864 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.23 -170.74 33.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.507 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.48 50.22 1.28 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.53 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -152.73 -178.47 6.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.31 . . . . 0.0 110.934 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.5 tpt -84.69 149.44 25.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 160.06 -31.43 0.4 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.52 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.9 m -107.18 -31.23 8.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.883 0.373 . . . . 0.0 110.951 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -64.11 -133.2 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.501 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.0 75.01 1.28 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.514 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.98 87.53 51.42 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.757 0.313 . . . . 0.0 110.929 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -51.58 164.68 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.524 2.149 . . . . 0.0 112.334 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 59.24 31.36 21.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.573 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -109.97 134.91 20.55 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.448 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.9 Cg_endo -60.94 125.91 18.29 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.422 2.081 . . . . 0.0 112.122 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.59 140.6 29.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.074 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.8 164.29 2.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -85.83 114.63 22.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.33 -73.03 0.38 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.613 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -100.26 153.63 19.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.822 0.344 . . . . 0.0 111.004 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.08 86.51 2.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.03 133.6 0.12 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.573 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.4 p80 -70.55 161.0 31.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.59 ' C ' HD23 ' A' ' 71' ' ' LEU . 9.6 mm -94.5 153.67 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.99 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.925 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.12 170.27 7.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -74.18 0.33 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.673 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.94 91.7 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.661 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.603 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.95 140.79 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.603 ' H ' HD13 ' A' ' 75' ' ' ILE . 7.6 mp -89.87 106.9 18.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.584 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -90.77 115.02 27.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.564 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -156.5 156.78 34.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.275 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.817 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 61.69 36.34 16.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.056 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.18 29.9 17.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -168.21 -178.45 3.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.413 ' HB2' HD12 ' A' ' 75' ' ' ILE . 26.2 p-80 -100.11 125.29 46.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.817 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.0 m95 -114.34 132.82 56.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.826 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.454 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.64 172.2 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.12 -40.12 28.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -91.0 -29.78 17.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.22 -30.92 70.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.763 HD23 ' O ' ' A' ' 97' ' ' LEU . 9.7 tp -72.29 77.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -135.6 165.72 24.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.78 138.44 41.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.84 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -29.58 68.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.914 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -105.08 -59.79 1.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -61.43 -39.9 92.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 58.48 22.29 9.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.02 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.6 m -85.78 156.25 58.46 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.219 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -59.66 118.9 5.84 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.607 2.205 . . . . 0.0 112.159 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.8 mp -112.96 54.89 0.71 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.712 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.429 ' C ' HD11 ' A' ' 28' ' ' ILE . . . -97.76 30.21 3.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.138 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.448 ' N ' HD11 ' A' ' 28' ' ' ILE . 22.2 mt-10 -141.48 -47.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.85 135.7 38.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.695 ' HB2' HG23 ' A' ' 28' ' ' ILE . 1.5 t -121.44 170.94 9.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.502 ' CZ ' ' CD2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -176.97 120.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.609 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t -131.72 157.72 43.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.876 0.37 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -170.22 124.0 0.72 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.887 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 -94.27 1.96 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.497 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -147.87 36.01 0.85 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.801 0.334 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.6 m -159.42 -176.88 6.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.535 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.6 p -136.3 116.19 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.129 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -110.47 166.87 10.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 22.6 p -90.83 168.07 11.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.685 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 0.1 OUTLIER -56.35 -44.92 80.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.962 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 12.2 t70 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -77.82 -21.0 52.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.35 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.502 ' CD2' ' CZ ' ' A' ' 102' ' ' PHE . 11.6 t80 -67.99 -44.08 77.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.368 . . . . 0.0 110.891 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 18.1 m-85 -60.67 -41.4 95.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -81.27 -30.43 34.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.351 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -80.96 -54.05 5.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.288 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -105.58 -43.09 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.104 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.53 164.71 11.28 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.487 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 16' ' ' MET . 85.8 m -60.72 155.08 19.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.774 0.321 . . . . 0.0 110.719 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -140.28 172.51 12.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.07 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.492 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.6 t -85.34 130.57 34.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.17 28.42 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.739 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.16 -53.76 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.78 -16.09 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.234 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.8 71.74 0.42 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.898 0.38 . . . . 0.0 110.81 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.437 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -128.09 -164.57 1.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -104.72 107.03 2.82 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.721 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.654 ' CG2' HD11 ' A' ' 15' ' ' LEU . 8.5 mt -87.89 127.35 58.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.4 0.143 . . . . 0.0 110.622 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 52.1 Cg_exo -53.14 177.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.241 1.96 . . . . 0.0 112.316 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.23 -49.16 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.082 2.522 . . . . 0.0 113.554 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.649 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.6 m -126.07 21.9 7.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.612 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -53.35 -175.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.328 . . . . 0.0 110.692 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.928 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -125.48 109.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 111.069 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.653 HG21 ' O ' ' A' ' 143' ' ' TYR . 14.5 p -156.95 160.34 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.87 138.13 34.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.652 179.896 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.412 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.3 OUTLIER -104.91 136.01 45.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.979 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.6 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.83 96.65 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.556 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 54.38 -87.16 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.087 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -96.88 -48.17 5.55 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.823 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.679 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.3 m-85 -84.4 163.01 19.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.644 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.43 HG11 ' CD1' ' A' ' 129' ' ' ILE . 9.9 p -108.62 151.31 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.708 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.739 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -129.01 170.21 13.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.945 0.403 . . . . 0.0 111.299 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.7 m80 -97.56 140.19 32.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.955 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.928 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.07 -21.26 44.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.565 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -91.13 -38.66 12.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.306 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -98.73 12.45 35.48 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.864 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 53.5 t80 -101.56 101.63 12.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -158.94 177.76 10.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 45.2 t -86.48 150.18 24.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.605 HG11 ' HG2' ' A' ' 170' ' ' ARG . 27.6 m -72.17 -36.69 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.317 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.597 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -88.4 -56.94 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.498 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.6 m -65.87 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.159 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? 59.66 32.84 21.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.943 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -128.97 153.01 47.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.03 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.594 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.8 mt-30 -72.16 174.54 7.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.714 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.8 OUTLIER -128.12 173.31 10.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.847 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 163.51 35.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.963 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.2 t -46.8 129.36 11.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.245 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 101.85 -25.31 28.38 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.464 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.519 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.6 t70 -70.45 129.18 38.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.821 0.343 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.95 122.0 31.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.04 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.595 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 5.4 p90 -139.25 155.45 47.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.955 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.451 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 34.4 m-85 -103.02 171.08 7.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.612 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.6 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -130.3 114.46 15.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.4 mmt -70.73 -178.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.11 -28.71 60.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -97.58 28.96 3.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.057 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.07 43.63 24.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.021 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.605 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.1 OUTLIER -100.72 124.09 45.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.864 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -74.66 120.83 20.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.726 HG23 ' OD2' ' A' ' 176' ' ' ASP . 12.5 p -145.3 127.39 9.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.1 m -72.34 -173.19 1.05 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.889 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.435 ' CE ' HG21 ' A' ' 7' ' ' VAL . 12.7 mttt -85.94 -32.24 21.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.84 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.42 -52.33 54.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.15 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.726 ' OD2' HG23 ' A' ' 172' ' ' VAL . 7.2 p-10 -85.21 3.98 36.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.429 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.451 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.6 t80 -59.17 -66.05 0.57 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.964 0.411 . . . . 0.0 110.763 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.32 -27.89 57.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 85.9 m -77.83 -35.43 51.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' ALA . . . . . 0.499 ' HB2' ' CG2' ' A' ' 152' ' ' VAL . . . -97.11 4.04 51.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.579 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.3 -177.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 110.862 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.914 179.977 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.828 0.347 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m 60.4 31.5 20.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 60.75 111.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.951 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 4' ' ' VAL . 10.9 m -126.69 82.79 66.48 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.085 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.33 -42.69 2.63 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.535 2.157 . . . . 0.0 112.31 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -141.76 87.8 2.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 12.0 p -121.77 158.6 25.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.07 -177.12 5.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.69 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.557 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.4 p -154.97 135.09 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.141 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 163' ' ' PHE . 47.9 t -59.27 146.17 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.63 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.88 -169.11 11.98 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.482 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.4 mm-40 -56.3 135.5 75.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.549 0.214 . . . . 0.0 110.744 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.636 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.2 Cg_exo -64.54 135.62 46.54 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.382 2.054 . . . . 0.0 112.385 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -162.94 147.69 11.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.544 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.757 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -117.77 173.35 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.109 0.48 . . . . 0.0 111.285 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.62 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -60.58 -36.24 78.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.721 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.916 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 57.66 74.88 0.29 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.09 -60.96 0.48 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.478 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 62.61 97.68 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.494 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -59.22 -166.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.899 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.43 147.44 19.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -84.03 -35.74 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.98 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -89.5 7.12 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.18 -31.22 34.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 33.4 tp10 -109.66 164.25 12.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -75.97 99.96 4.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.951 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 101' ' ' CYS . 2.0 tp -79.72 165.07 23.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.813 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.6 pt -62.89 164.16 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.464 HG22 ' HG ' ' A' ' 31' ' ' LEU . 59.5 m -126.82 107.07 9.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.774 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.99 101.78 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.547 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.09 151.26 36.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.952 -179.803 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -82.04 156.97 24.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -115.7 144.44 43.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 p -96.85 40.02 1.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 38' ' ' ALA . 0.2 OUTLIER -87.53 -70.29 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 63.7 -79.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.007 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -69.82 -75.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.414 ' HB2' ' CG ' ' A' ' 35' ' ' GLN . . . 64.68 -78.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.132 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.721 ' HB2' HG21 ' A' ' 57' ' ' THR . . . -165.62 108.63 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 60.71 32.5 20.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.947 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.74 -29.84 68.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.484 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.7 mm -82.3 104.06 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 110.943 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.34 87.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.22 -46.69 0.92 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -65.03 118.3 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.89 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.69 122.66 2.66 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 113.4 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.489 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 t -133.46 177.89 7.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.867 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.88 46.3 3.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.487 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.45 28.45 2.88 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.514 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -165.39 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 110.936 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -176.4 -44.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 136.19 143.89 4.76 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.483 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -87.55 -74.65 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.757 0.313 . . . . 0.0 110.844 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.52 132.6 3.27 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.501 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -103.04 -163.02 25.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.462 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.721 HG21 ' HB2' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -107.03 82.97 1.21 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.0 110.965 179.998 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.45 169.0 18.09 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.534 2.156 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 58.41 29.09 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.834 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.447 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.2 tp -99.49 135.5 20.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 11.8 Cg_endo -56.39 125.93 20.65 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.407 2.071 . . . . 0.0 112.047 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.12 137.94 31.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.3 p -58.37 164.22 2.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.881 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.25 114.63 24.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.27 -71.48 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.66 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.5 p -103.48 155.68 18.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.37 88.3 3.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.112 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -178.44 136.62 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.556 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.4 p-80 -73.67 157.13 37.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.009 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.528 HD11 ' CD2' ' A' ' 84' ' ' HIS . 3.9 mm -88.77 151.55 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.556 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.8 OUTLIER -176.92 37.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.019 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -103.36 179.91 4.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -39.8 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.713 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -109.21 110.22 21.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.446 HG22 ' N ' ' A' ' 76' ' ' LEU . 40.9 mm -120.0 154.79 22.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.389 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.446 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.53 107.06 15.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.093 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.7 119.0 30.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.01 162.71 41.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.148 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.733 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 57.01 36.32 27.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 62.54 30.38 17.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.009 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 21.0 mtt180 -164.2 -178.99 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.015 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 32.9 p-80 -98.8 121.24 40.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.022 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.733 ' NE1' HD12 ' A' ' 79' ' ' LEU . 46.1 m95 -112.48 130.46 55.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.528 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.39 171.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.881 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -79.93 -41.08 26.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.991 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -89.77 -28.61 19.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.016 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.83 -30.78 68.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 97' ' ' LEU . 8.1 tp -72.14 80.39 0.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mmtt -144.63 141.12 29.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.914 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 11.6 t -59.8 132.45 54.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.1 m -77.85 -4.3 45.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.504 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -111.31 -31.8 6.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.065 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 95' ' ' VAL . 14.1 m -111.87 -30.48 7.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.149 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 60.77 25.26 15.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.944 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 93' ' ' CYS . 3.5 m -85.27 159.84 55.61 Favored Pre-proline 0 N--CA 1.453 -0.299 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.213 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.494 ' O ' HD12 ' A' ' 97' ' ' LEU . 35.7 Cg_exo -59.9 121.2 9.45 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.685 2.257 . . . . 0.0 112.312 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.669 ' O ' HD23 ' A' ' 88' ' ' LEU . 5.6 mp -124.55 30.48 5.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.698 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.49 61.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.555 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.813 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.4 mt-10 -92.04 -39.9 11.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.994 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.465 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -140.17 170.74 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.893 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.742 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.3 t -150.89 156.16 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.8 t80 -157.94 119.91 3.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.79 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.466 ' HB3' HD22 ' A' ' 79' ' ' LEU . 10.8 t -130.83 162.27 29.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 4.2 mmm-85 -153.63 124.04 7.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.77 -78.54 0.74 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -133.91 -74.29 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.778 0.323 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 m -59.8 164.66 3.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.3 p -107.3 115.93 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.65 120.89 39.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.799 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 27.3 p -60.09 170.51 1.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.11 -31.88 50.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.196 -179.739 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -50.82 -58.01 7.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.438 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.53 -20.97 58.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.494 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 9.5 t80 -60.14 -26.97 66.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.675 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -79.28 -44.3 21.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.956 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -85.29 -62.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.721 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.05 -50.77 72.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.78 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 6.0 m-85 -88.29 -43.03 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.684 0.278 . . . . 0.0 111.362 -179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.76 -168.36 36.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.432 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.62 HG21 ' SD ' ' A' ' 16' ' ' MET . 24.3 m -58.95 148.69 29.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -151.38 162.22 41.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.803 ' HB2' HD11 ' A' ' 129' ' ' ILE . 42.5 t -79.83 127.6 32.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.943 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.55 30.67 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -124.99 -56.39 1.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.058 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.74 -22.43 11.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.11 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 71.47 73.22 0.18 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.957 0.408 . . . . 0.0 110.912 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.443 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -128.53 -164.54 1.39 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.807 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -109.38 106.11 2.16 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.616 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.803 HD11 ' HB2' ' A' ' 122' ' ' CYS . 2.4 mt -94.97 128.02 40.75 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.448 0.166 . . . . 0.0 110.657 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.619 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.7 Cg_exo -52.25 175.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.196 1.931 . . . . 0.0 112.197 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.37 -47.3 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.646 2.23 . . . . 0.0 113.871 -179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.916 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.53 21.91 7.73 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.177 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.654 HE21 HG23 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -56.73 -170.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.594 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.636 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.15 108.66 23.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.751 0.31 . . . . 0.0 110.544 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.757 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.2 p -157.19 161.72 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.167 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.543 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 135.06 39.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.246 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.722 ' HB3' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -115.65 144.43 43.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.088 -179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.815 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -84.45 96.67 9.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.422 ' NE2' ' SD ' ' A' ' 8' ' ' MET . 0.0 OUTLIER 43.44 -89.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.529 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.1 m-20 -84.61 -44.5 13.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.749 -177.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 169' ' ' SER . 7.2 m-85 -91.64 167.21 12.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.473 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.722 HG23 ' HB3' ' A' ' 137' ' ' ARG . 9.3 p -124.61 119.78 57.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.901 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 6.0 m-85 -102.98 138.7 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.443 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 64.4 m80 -60.82 141.27 57.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.677 HD23 ' HB ' ' A' ' 135' ' ' VAL . 0.4 OUTLIER -61.29 -18.79 60.23 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.433 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -88.24 -36.7 16.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.912 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.9 OUTLIER -100.89 21.27 13.94 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.447 -179.676 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.702 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 5.6 t80 -89.8 109.75 20.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.841 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.08 157.71 4.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.959 0.409 . . . . 0.0 111.259 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.16 150.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 171' ' ' LEU . 10.8 m -91.09 22.47 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.508 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 39.2 t -136.74 -62.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.813 0.339 . . . . 0.0 110.618 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.9 p -85.02 -20.83 29.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.653 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 65.01 61.75 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.193 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -129.13 137.58 51.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.071 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 157' ' ' LEU . 13.5 mt-30 -68.17 154.06 42.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.725 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.4 OUTLIER -122.68 147.1 46.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.64 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -127.54 165.89 19.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.0 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -46.05 128.2 9.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.206 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.17 -26.67 22.24 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.557 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.5 m-20 -70.82 128.96 37.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.813 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -87.99 118.84 27.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.035 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.686 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.2 p90 -135.63 151.28 50.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 174' ' ' LYS . 26.0 m-85 -97.06 171.01 8.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.795 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.815 HD11 ' HB1' ' A' ' 138' ' ' ALA . 2.8 tp -132.22 118.39 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.782 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.7 mmt -56.38 164.26 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -58.2 -30.46 66.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.159 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.92 -79.04 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.994 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' SER . . . . . 0.437 ' HB3' ' CE1' ' A' ' 141' ' ' PHE . 36.5 p 178.99 77.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.804 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.582 ' CG ' HG11 ' A' ' 151' ' ' VAL . 7.6 mtt180 -144.5 119.38 9.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.702 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -66.92 121.43 15.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.841 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -139.09 140.76 37.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.001 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.31 160.99 14.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 164' ' ' TYR . 9.4 mttp -58.12 -46.84 84.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.136 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.35 -27.15 62.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.308 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -104.07 -6.87 20.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.447 ' CE2' ' CB ' ' A' ' 182' ' ' GLN . 8.3 t80 -56.2 -66.04 0.5 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.843 0.354 . . . . 0.0 110.986 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.6 -31.37 72.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.928 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -31.5 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.873 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -78.29 -52.02 9.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.13 -67.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.947 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 182' ' ' GLN . . . . . 0.447 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.922 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.85 0.357 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -134.65 88.82 2.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -131.87 36.79 3.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.2 m -138.56 149.84 64.0 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.09 -168.03 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.92 103.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.487 HG22 ' N ' ' A' ' 8' ' ' MET . 14.2 p -123.96 158.87 29.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.189 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.597 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -140.95 179.18 6.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.716 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.523 HG23 ' C ' ' A' ' 161' ' ' ASP . 7.3 p -155.11 133.81 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.1 t -54.8 146.31 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.662 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.488 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -143.23 -140.76 3.73 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.702 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 24.3 mt-10 -72.96 117.04 56.47 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.527 0.204 . . . . 0.0 110.865 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.92 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.03 137.51 52.87 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.388 2.059 . . . . 0.0 112.115 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.05 153.96 16.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.787 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.814 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -124.86 173.47 8.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.109 0.481 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.408 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.09 -28.42 68.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.692 179.588 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.926 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.35 61.05 7.82 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.527 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.65 -67.13 1.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.545 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 65.92 67.72 0.47 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.946 0.403 . . . . 0.0 110.739 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -75.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.03 153.8 30.59 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.06 -34.19 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -62.05 -31.17 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -68.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 102' ' ' PHE . 67.5 mm-40 -65.1 175.99 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 119.05 19.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.44 HD11 ' CB ' ' A' ' 100' ' ' ARG . 1.7 tp -103.68 165.05 11.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.914 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.853 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.9 pt -62.88 146.89 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.168 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.6 m -113.62 106.86 15.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 76' ' ' LEU . 1.3 tpp180 -77.61 101.83 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.59 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.05 166.06 26.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.961 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.43 157.03 23.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.1 -29.1 9.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.885 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.71 36.84 13.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.915 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -133.83 77.45 1.71 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 73' ' ' ARG . 47.1 m-85 -80.62 -74.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.87 86.43 4.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.2 -68.57 0.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.061 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.15 17.45 2.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.447 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -168.98 -47.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.845 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.7 -143.81 23.71 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.55 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.626 ' N ' HD12 ' A' ' 42' ' ' ILE . 2.6 mp -84.24 -70.93 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.802 0.334 . . . . 0.0 110.876 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.28 128.62 37.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -103.14 174.7 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.957 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.65 -59.18 3.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.62 179.65 26.84 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.546 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.84 -152.84 17.41 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.458 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -147.93 -178.87 6.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.876 0.369 . . . . 0.0 110.929 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.87 -73.11 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.468 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.05 -30.73 2.23 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.463 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -143.54 -178.37 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.785 0.326 . . . . 0.0 110.888 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -138.33 141.17 39.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.92 84.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.49 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 p -168.39 33.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.881 0.372 . . . . 0.0 110.89 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.8 168.34 11.51 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.469 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 148.55 -160.69 28.45 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.547 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -115.61 83.01 10.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.655 0.264 . . . . 0.0 110.835 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.95 165.86 1.09 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.522 2.148 . . . . 0.0 112.173 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 58.3 30.56 19.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.833 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.496 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -107.45 135.22 19.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.991 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.429 ' HD2' HD12 ' A' ' 60' ' ' ILE . 21.9 Cg_endo -62.27 125.9 17.37 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.359 2.04 . . . . 0.0 112.021 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.79 150.69 22.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.7 t -58.52 140.51 53.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.711 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -62.1 114.85 3.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.71 28.77 45.62 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.98 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.65 -178.9 5.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.876 0.369 . . . . 0.0 110.849 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.6 -28.35 10.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.52 -167.58 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.496 ' CD2' HG21 ' A' ' 60' ' ' ILE . 6.2 p80 -107.54 171.76 7.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.971 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.513 ' C ' HD23 ' A' ' 71' ' ' LEU . 10.4 mm -91.57 153.48 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.059 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.513 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.84 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.826 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.586 ' HB2' HD11 ' A' ' 75' ' ' ILE . 11.1 m-20 -100.36 -178.9 3.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.926 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 36' ' ' PHE . 15.2 tpt180 -86.88 -70.11 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.986 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.596 ' C ' HD12 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -81.35 105.66 12.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.111 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.596 HD12 ' C ' ' A' ' 74' ' ' PHE . 1.3 mp -113.12 153.8 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.825 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 30' ' ' ARG . 8.6 mp -104.79 111.95 24.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.797 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -90.95 139.03 31.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.982 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -176.7 150.59 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.119 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.3 OUTLIER 58.64 37.26 25.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 62.09 30.35 17.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.111 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -166.33 167.97 15.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.895 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -92.45 117.96 30.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.646 ' CB ' HD13 ' A' ' 88' ' ' LEU . 69.3 m95 -105.73 125.13 50.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.67 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 175.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.955 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t -77.29 -42.08 38.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.898 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 ttpm? -91.14 -34.09 15.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 30.6 m -67.48 -28.2 67.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 83' ' ' TRP . 48.7 tp -72.8 89.18 1.35 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.908 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.3 mttt -152.93 155.94 37.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -59.9 146.97 40.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 m -73.1 -30.98 64.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 -60.51 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.96 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.414 ' HB2' HG22 ' A' ' 95' ' ' VAL . 35.2 m -59.73 -34.25 72.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 57.77 22.25 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.097 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.442 HG23 HD11 ' A' ' 97' ' ' LEU . 4.2 m -85.18 156.33 60.13 Favored Pre-proline 0 N--CA 1.453 -0.284 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.38 118.97 6.0 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.471 2.114 . . . . 0.0 112.253 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.568 ' O ' HD23 ' A' ' 88' ' ' LEU . 11.2 mp -111.43 60.8 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.85 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.68 36.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.081 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -153.42 -46.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.881 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.44 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -128.4 138.57 52.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.919 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.853 ' HB2' HG23 ' A' ' 28' ' ' ILE . 49.4 t -131.06 156.97 44.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 104' ' ' ARG . 13.5 t80 -169.08 119.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.74 ' HB2' HD22 ' A' ' 79' ' ' LEU . 10.7 t -97.27 153.18 18.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.44 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -176.71 124.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.871 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.89 41.07 24.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 59.52 31.4 20.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.857 0.361 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.6 m -161.62 165.79 27.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.858 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.543 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.7 p -85.47 115.99 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.058 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -125.63 120.93 32.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.935 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.1 p -69.9 163.61 25.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -78.14 -24.96 47.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.353 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.436 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -55.56 -58.16 8.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 111.284 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -73.32 -20.75 60.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.254 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.444 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 32.9 t80 -61.98 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.7 m-85 -72.88 -44.79 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -79.89 -31.85 40.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.055 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -57.84 2.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.062 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 23.8 m-85 -99.04 31.13 3.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.973 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.14 169.06 32.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.404 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 86.2 m -59.78 153.56 20.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.765 0.317 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -154.9 170.66 21.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.03 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 18.8 t -81.22 137.96 35.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.82 14.03 16.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.51 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.09 -41.54 2.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.937 0.399 . . . . 0.0 111.064 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.8 m -105.9 -20.58 13.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.095 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 64.31 29.27 13.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.746 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tp -99.58 150.02 22.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.812 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.93 96.59 0.6 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.652 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.458 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 5.2 mt -59.86 140.32 90.02 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.478 0.18 . . . . 0.0 110.678 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.645 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.6 Cg_exo -48.24 175.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.301 2.001 . . . . 0.0 112.11 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.443 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.5 Cg_endo -77.38 -55.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.365 2.043 . . . . 0.0 113.948 -179.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.926 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -122.36 21.72 10.23 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.271 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.645 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.9 OUTLIER -60.07 139.07 57.71 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.649 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.92 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -74.89 108.71 6.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.826 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.814 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.0 p -151.78 161.07 3.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.12 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.81 141.86 29.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.859 0.361 . . . . 0.0 110.591 179.858 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.56 ' HG2' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.87 130.03 53.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.975 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.695 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -82.56 96.67 8.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.739 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.628 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.86 -86.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.451 0.644 . . . . 0.0 111.855 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -100.23 -48.41 4.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.954 -177.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -91.34 174.67 7.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.759 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.56 HG22 ' HG2' ' A' ' 137' ' ' ARG . 32.5 t -121.43 150.23 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.703 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.695 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 2.6 m-85 -131.34 138.99 49.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.423 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 70.1 m80 -55.12 144.93 22.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.846 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -64.3 -17.85 64.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.225 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.93 -38.34 14.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.078 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.8 p -95.48 25.21 4.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.531 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.832 ' CE1' HD11 ' A' ' 171' ' ' LEU . 0.9 OUTLIER -104.36 112.24 25.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.8 0.333 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.442 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.03 160.59 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.123 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -59.7 150.04 28.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 152' ' ' VAL . 6.5 m -67.31 -27.31 38.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.343 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 151' ' ' VAL . 20.1 t -108.54 -55.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.36 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 40.3 m -66.04 -28.0 68.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.078 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LYS . . . . . 0.442 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 9.8 mmtt 55.21 36.78 27.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.997 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -109.8 137.79 47.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.2 mt-30 -64.02 154.42 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.0 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.696 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.4 mm? -113.79 163.85 14.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.703 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 170.92 15.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.488 HG23 ' HA2' ' A' ' 11' ' ' GLY . 4.4 m -44.69 123.03 3.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.501 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.92 -24.36 32.56 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.679 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.523 ' C ' HG23 ' A' ' 9' ' ' VAL . 5.0 t0 -67.07 128.98 38.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.744 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.482 ' HA ' HG23 ' A' ' 9' ' ' VAL . 5.1 mt-10 -87.87 128.95 35.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.142 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.597 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 12.5 p90 -143.43 141.11 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.601 ' HB2' HG13 ' A' ' 172' ' ' VAL . 14.8 m-85 -97.96 171.07 8.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.796 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.628 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.5 tp -131.73 110.99 11.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.792 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 5.7 mmt -60.98 172.32 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -66.11 -30.22 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -98.21 29.18 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.44 84.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.974 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.434 ' CG ' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -149.49 129.54 13.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.914 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.832 HD11 ' CE1' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -73.74 126.11 29.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.601 HG13 ' HB2' ' A' ' 164' ' ' TYR . 11.3 p -145.06 135.75 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 29.6 p -80.29 167.23 20.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.875 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -57.54 -49.64 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.066 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.6 63.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -94.98 -15.45 23.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.261 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 7.7 t80 -55.58 -66.04 0.49 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.053 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.2 -29.5 70.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 4.3 m -72.81 -33.3 66.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.029 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.6 -30.88 15.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.201 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm 61.44 175.77 0.11 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t 60.6 158.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.863 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -102.34 -55.1 2.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.91 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.9 m -60.03 149.54 73.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.083 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.72 78.07 1.37 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.509 2.139 . . . . 0.0 112.336 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.71 106.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.872 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.495 HG22 ' N ' ' A' ' 8' ' ' MET . 14.0 p -125.84 159.28 34.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.495 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -131.53 -175.62 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.7 p -155.03 139.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.263 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.465 HG22 ' CE1' ' A' ' 163' ' ' PHE . 39.8 t -66.55 146.09 13.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.665 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.01 -167.21 12.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.49 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 11.0 mt-10 -62.58 149.84 87.63 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.628 0.251 . . . . 0.0 110.832 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.1 Cg_endo -83.01 136.08 7.86 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.848 2.365 . . . . 0.0 112.399 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.06 142.89 5.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.301 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.752 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -117.95 173.46 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.409 -179.639 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.62 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.27 -44.21 92.46 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.005 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.831 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 60.13 102.45 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.436 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.12 -44.69 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.567 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 62.77 20.51 12.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.66 0.267 . . . . 0.0 110.978 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.496 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 55.54 -173.95 0.05 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.822 0.344 . . . . 0.0 111.047 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.57 152.32 16.84 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.1 -31.08 25.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.912 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -88.14 7.05 33.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.427 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.85 -67.97 0.42 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.9 tp10 -110.83 176.06 5.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.907 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 136.89 40.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mp -111.96 165.06 12.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.874 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.759 HG21 HD21 ' A' ' 88' ' ' LEU . 6.5 pt -62.94 135.19 27.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -99.24 106.87 19.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.741 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD2' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.64 101.83 11.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.471 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.461 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.47 163.03 35.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.986 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -86.59 150.9 23.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.931 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -98.31 -31.37 12.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.936 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 m 60.26 31.66 20.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.31 -73.09 0.49 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 73' ' ' ARG . 5.2 m-85 64.17 -78.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.983 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -74.94 111.49 10.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.09 99.74 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.57 -169.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.066 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -61.81 84.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.85 -76.05 1.24 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.463 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.7 mm -82.42 119.23 31.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.69 -176.46 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.8 114.82 17.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -103.67 81.26 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.843 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 64.06 127.26 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.4 -87.1 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.469 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.73 136.59 38.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.803 0.335 . . . . 0.0 110.962 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 145.46 45.41 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.488 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 161.33 -154.87 25.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.386 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -103.01 -36.45 8.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.92 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 7.3 mtt -75.04 168.32 20.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.02 -62.52 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.511 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 m 60.46 35.6 20.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.811 0.338 . . . . 0.0 110.889 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -154.55 163.39 31.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.16 116.33 4.15 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.547 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.24 89.52 4.79 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.667 0.27 . . . . 0.0 110.9 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.38 165.64 26.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.175 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 58.36 29.82 18.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.767 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.452 HD12 ' HD2' ' A' ' 61' ' ' PRO . 2.9 tp -103.02 135.66 19.36 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' HD12 ' A' ' 60' ' ' ILE . 19.3 Cg_endo -59.88 125.92 19.01 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.408 2.072 . . . . 0.0 111.891 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.55 149.01 21.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.4 t -58.22 137.39 57.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.705 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.448 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -61.06 114.76 3.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.266 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.47 28.38 39.91 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.914 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.54 -178.86 5.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.837 0.351 . . . . 0.0 110.96 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.9 -28.79 9.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.691 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.26 -165.94 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.703 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -110.76 154.56 23.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.008 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.7 mm -66.92 153.72 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.404 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.4 OUTLIER -168.83 33.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.783 -179.858 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -109.38 -178.97 3.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -95.13 -35.73 11.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.582 ' O ' HD13 ' A' ' 75' ' ' ILE . 1.9 m-85 -105.03 115.68 30.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.055 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.1 mm -133.62 153.88 37.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.229 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.9 mp -113.18 107.93 16.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.278 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -90.77 123.21 34.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.043 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.725 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.48 162.19 35.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.051 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.65 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 57.85 35.47 25.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.47 40.76 10.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.02 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.45 171.13 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -93.2 117.92 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.65 ' NE1' HD12 ' A' ' 79' ' ' LEU . 73.5 m95 -109.72 125.41 52.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.791 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 176.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.957 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.01 -42.01 24.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.13 -15.56 29.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.113 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.5 m -96.74 26.16 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.734 0.302 . . . . 0.0 111.083 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.759 HD21 HG21 ' A' ' 28' ' ' ILE . 2.8 tp -124.06 29.55 6.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 152.21 20.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.16 147.03 52.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -66.56 -29.61 69.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.032 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -106.13 -58.38 1.92 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 17.0 m -59.92 -37.67 80.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 58.0 22.58 9.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.028 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -87.01 155.9 55.12 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.151 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.21 118.94 5.75 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.513 2.142 . . . . 0.0 112.339 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.457 HD23 ' SG ' ' A' ' 101' ' ' CYS . 8.8 mp -101.81 70.69 1.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.89 35.19 1.75 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.108 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.545 ' C ' HD11 ' A' ' 28' ' ' ILE . 31.2 mm-40 -152.42 -48.51 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -149.41 157.76 43.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.909 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HD23 ' A' ' 97' ' ' LEU . 20.0 t -157.02 128.0 6.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.9 m-85 -98.45 171.96 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.562 ' HB2' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -155.59 140.43 17.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.874 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -153.64 124.0 7.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.818 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.34 -122.84 15.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.536 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -113.07 36.08 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 165.53 29.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.527 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.3 p -117.07 116.0 50.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.13 159.38 21.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.7 p -100.92 176.76 5.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.793 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.16 -29.44 48.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.332 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.79 -58.05 9.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -71.27 -20.89 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.293 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 5.9 t80 -65.67 -30.11 70.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 111.144 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 4.0 m-85 -79.08 -44.44 22.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.1 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -79.26 -41.8 27.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.212 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -83.02 -55.72 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.259 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -96.99 37.07 1.34 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.914 0.387 . . . . 0.0 111.139 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -156.45 -167.38 17.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.455 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.612 HG21 ' SD ' ' A' ' 16' ' ' MET . 2.4 m -59.79 150.05 29.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.786 0.327 . . . . 0.0 110.902 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -153.65 175.5 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.882 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.614 ' HB2' HD11 ' A' ' 129' ' ' ILE . 47.2 t -88.0 132.1 34.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.992 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.4 27.45 4.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.037 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.87 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -55.34 1.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.964 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 23.7 p -111.16 -17.44 13.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.169 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 66.45 73.68 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.873 0.368 . . . . 0.0 110.882 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.453 ' CB ' ' CE1' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -127.97 -163.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.731 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -111.34 97.0 0.92 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.734 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.701 HG22 HD11 ' A' ' 15' ' ' LEU . 1.7 mt -82.03 129.31 64.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.426 0.155 . . . . 0.0 110.63 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 77.5 Cg_exo -48.5 173.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.281 1.987 . . . . 0.0 112.337 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.1 Cg_endo -77.48 -47.54 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.558 2.172 . . . . 0.0 113.892 -179.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.831 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.2 m -126.22 21.85 7.29 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -56.18 -171.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.539 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.766 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -121.02 108.3 22.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.782 0.325 . . . . 0.0 110.554 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.752 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.6 p -157.41 156.06 4.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.276 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.45 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.68 139.24 33.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.59 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.85 129.43 53.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.92 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -64.41 96.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.515 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.45 -88.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.857 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -88.8 -42.15 12.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.991 -1.004 . . . . 0.0 112.53 -177.03 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 5.2 m-85 -99.58 166.34 11.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.052 0.453 . . . . 0.0 112.12 -178.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.1 p -105.17 147.48 10.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.633 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.87 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 17.8 m-85 -132.62 142.59 49.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.881 0.372 . . . . 0.0 111.353 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 127' ' ' LEU . 66.4 m80 -70.4 145.08 51.33 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.02 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.766 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.2 OUTLIER -64.97 -17.74 64.66 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.228 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -88.48 -46.48 9.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.544 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 2.5 p -84.83 -33.73 22.83 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.806 ' CE1' HD21 ' A' ' 171' ' ' LEU . 36.8 t80 -56.99 99.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.88 0.371 . . . . 0.0 110.972 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.01 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.108 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 150.01 26.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.943 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.836 HG13 ' O ' ' A' ' 171' ' ' LEU . 23.7 m -70.44 -30.56 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.154 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.784 HG23 HG23 ' A' ' 151' ' ' VAL . 19.8 t -106.99 -51.5 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.125 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 42.5 m -66.05 -28.14 68.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 24.0 mttp 54.84 39.62 31.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.03 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -127.84 141.83 51.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.907 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.497 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.8 mt-30 -61.93 166.2 4.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.714 ' N ' HD22 ' A' ' 157' ' ' LEU . 0.8 OUTLIER -122.44 172.21 8.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 164.61 31.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.07 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -47.16 128.82 12.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.317 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.08 21.79 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.469 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.7 m-20 -66.35 128.91 38.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.631 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -90.48 117.34 29.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.13 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.687 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.0 p90 -133.75 168.27 19.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.848 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.696 ' HB2' HG13 ' A' ' 172' ' ' VAL . 61.4 m-85 -114.71 171.03 7.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.768 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.71 123.2 30.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 10.2 mmt -83.13 168.74 16.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.971 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -59.75 -28.49 67.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.012 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -97.35 28.16 3.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.1 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.38 38.53 28.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.43 141.73 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.836 ' O ' HG13 ' A' ' 151' ' ' VAL . 0.3 OUTLIER -90.31 125.08 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.967 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.696 HG13 ' HB2' ' A' ' 164' ' ' TYR . 12.3 p -145.11 130.24 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.46 -173.44 4.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.023 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -61.08 2.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.08 -23.56 47.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.366 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.695 ' HB3' HG23 ' A' ' 172' ' ' VAL . 85.4 m-20 -89.98 -23.38 21.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.063 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.502 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.1 t80 -54.54 -66.03 0.47 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.839 0.352 . . . . 0.0 111.045 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -55.56 -26.18 42.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.119 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 72.4 m -82.02 -27.66 32.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.12 -20.69 18.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.387 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.72 -178.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.5 m . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.76 0.314 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.5 p -104.73 107.89 19.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.49 -176.11 1.81 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.897 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.718 HG12 HG11 ' A' ' 7' ' ' VAL . 18.6 m -139.67 81.94 18.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.214 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.47 -41.47 3.35 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.57 2.18 . . . . 0.0 112.312 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -157.26 37.7 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.718 HG11 HG12 ' A' ' 4' ' ' VAL . 13.4 p -100.93 158.9 3.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.153 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.483 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -155.95 -177.95 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.595 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.2 p -155.1 131.84 2.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.276 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG23 ' CD1' ' A' ' 163' ' ' PHE . 52.9 t -55.41 146.16 4.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.464 ' C ' HG23 ' A' ' 159' ' ' THR . . . -128.09 -151.86 7.68 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.739 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -73.69 128.24 87.24 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.473 0.177 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.7 ' HB2' HG12 ' A' ' 134' ' ' VAL . 33.5 Cg_exo -55.94 151.17 42.75 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.27 1.98 . . . . 0.0 112.342 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.04 149.75 7.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.36 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.659 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.0 OUTLIER -144.07 173.49 11.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.225 -179.471 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.402 ' HE1' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -57.17 -52.94 63.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.767 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.588 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 59.18 83.24 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.457 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -167.15 -43.55 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.519 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 63.45 27.3 15.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 0.0 110.774 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.508 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 61.23 -170.19 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.839 -179.983 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.05 150.26 22.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.522 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.739 ' HB3' HD22 ' A' ' 27' ' ' LEU . 40.0 m-20 -83.91 -42.69 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.866 0.365 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.87 -29.15 68.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.29 -74.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.949 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG2' ' CG ' ' A' ' 102' ' ' PHE . 30.5 tp10 -72.92 163.44 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.958 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -76.0 99.94 4.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 22' ' ' ASP . 2.0 tp -77.38 163.25 26.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.906 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.966 HG21 HD21 ' A' ' 88' ' ' LEU . 6.7 pt -62.86 149.28 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.198 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 m -107.78 106.85 17.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.38 101.78 12.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.393 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -150.3 166.1 31.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.936 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -89.73 151.55 21.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.488 ' ND2' ' HB ' ' A' ' 75' ' ' ILE . 0.6 OUTLIER -94.27 -178.57 4.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.855 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.558 ' O ' HG22 ' A' ' 34' ' ' THR . 28.8 m -133.29 35.65 3.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -97.49 -74.43 0.57 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 68.06 -69.64 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -105.7 83.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.885 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.523 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . . . -131.15 79.1 1.87 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.704 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . . . 60.61 107.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.15 79.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.39 -126.24 0.79 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.462 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.632 ' N ' HD12 ' A' ' 42' ' ' ILE . 2.5 mp -84.12 -72.17 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.349 . . . . 0.0 110.885 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.7 171.02 3.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 60.5 80.09 0.22 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -100.74 80.53 2.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.53 130.54 10.27 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.553 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -90.34 107.66 3.47 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.515 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 m -66.31 98.56 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.868 0.366 . . . . 0.0 110.904 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 136.58 137.34 3.64 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.533 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.93 -28.68 14.08 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.508 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -158.47 -45.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.5 mtm -87.27 -178.14 6.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -100.88 -168.57 28.42 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.513 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -106.67 -170.06 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.909 0.385 . . . . 0.0 110.849 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 140.64 142.9 4.23 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.499 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.13 -160.8 27.27 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.512 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.51 83.0 10.37 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.701 0.286 . . . . 0.0 110.948 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.76 165.38 1.17 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.493 2.129 . . . . 0.0 112.195 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 58.64 30.66 20.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.521 HD13 ' CD2' ' A' ' 69' ' ' HIS . 8.3 tt -107.95 136.24 19.77 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.995 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HD2' HG13 ' A' ' 60' ' ' ILE . 19.6 Cg_endo -61.57 125.95 17.96 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.288 1.992 . . . . 0.0 111.98 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.6 157.72 15.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.177 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.404 ' HB2' HG12 ' A' ' 70' ' ' ILE . 4.9 t -58.26 142.49 47.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.494 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . . . -62.9 114.75 3.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.27 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.72 28.53 46.55 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.997 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.43 -178.92 5.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.854 0.359 . . . . 0.0 110.944 -179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -109.19 -29.31 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.83 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -104.67 -165.67 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.847 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.704 ' CE1' ' HB3' ' A' ' 39' ' ' ALA . 3.7 p80 -106.6 173.42 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.986 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.561 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.3 mm -92.05 153.81 3.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.196 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.561 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -165.8 31.65 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.806 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.33 -178.96 3.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.459 HH22 HD11 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -96.23 -36.15 11.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.002 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.547 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.3 m-85 -106.72 116.66 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.547 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.9 mm -134.41 154.02 36.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.284 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.6 mp -112.81 108.95 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.291 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.71 123.3 34.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.1 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.711 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -158.32 161.06 37.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.055 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.79 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 57.59 35.83 26.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.017 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 62.63 35.81 14.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.82 168.94 5.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 41.6 p-80 -94.21 117.95 30.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.925 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.79 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 56.2 m95 -110.08 127.23 54.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.709 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.9 175.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.116 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.05 -39.26 30.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.651 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -91.06 -34.67 15.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 9.3 m -71.43 -28.4 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.966 HD21 HG21 ' A' ' 28' ' ' ILE . 57.7 tp -74.56 81.12 1.98 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -147.3 162.35 39.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.874 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.96 147.03 48.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -29.95 60.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.134 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.57 -63.01 1.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.497 ' HB2' HG22 ' A' ' 95' ' ' VAL . 19.4 m -59.31 -32.7 70.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.032 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 56.35 23.03 6.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.151 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.497 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -88.09 147.39 40.49 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.143 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.39 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.503 2.135 . . . . 0.0 112.286 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.4 mp -108.99 65.0 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.741 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.98 30.56 3.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.165 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.666 ' C ' HD11 ' A' ' 28' ' ' ILE . 25.5 mm-40 -140.47 -49.64 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.59 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -139.21 167.37 22.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.819 179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.661 ' HB2' HG23 ' A' ' 28' ' ' ILE . 9.0 t -157.0 127.96 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.984 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.481 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.5 OUTLIER -113.07 156.17 23.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.808 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.4 p -145.33 127.39 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.966 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -149.1 123.99 9.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -92.47 1.81 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.477 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -157.78 36.08 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.805 0.336 . . . . 0.0 110.838 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -154.82 152.16 29.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.876 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.3 p -84.15 115.99 27.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -118.84 158.13 26.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.536 ' HB3' HD21 ' A' ' 97' ' ' LEU . 30.2 p -99.93 171.7 7.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.691 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.04 -32.61 51.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.347 -179.724 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 3.7 t0 -51.53 -58.11 7.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.43 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -73.33 -20.68 60.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.328 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.508 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 8.5 t80 -62.32 -31.53 72.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.864 0.364 . . . . 0.0 110.815 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.3 m-85 -74.22 -35.26 63.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.755 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -85.09 -55.56 3.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.148 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -71.55 -48.26 49.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.348 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 5.4 m-85 -103.27 37.07 2.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.872 0.368 . . . . 0.0 111.087 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.74 173.13 35.07 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.585 HG22 ' CG1' ' A' ' 142' ' ' VAL . 0.2 OUTLIER -59.06 155.03 14.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.717 0.294 . . . . 0.0 110.895 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.408 ' C ' HD11 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -166.15 160.14 15.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.035 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.409 ' N ' HD11 ' A' ' 129' ' ' ILE . 49.6 t -57.9 136.91 57.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.19 19.69 5.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.296 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.3 -48.29 1.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.827 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 1.8 m -111.02 -15.24 13.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.139 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 65.3 29.89 11.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.916 0.389 . . . . 0.0 110.627 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tp -82.62 136.08 34.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.765 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -55.69 99.96 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.731 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.409 HD11 ' N ' ' A' ' 122' ' ' CYS . 46.1 mt -63.37 128.55 92.65 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.476 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 88.1 Cg_exo -44.22 169.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.547 2.165 . . . . 0.0 112.691 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.07 -47.03 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.622 2.214 . . . . 0.0 113.987 -178.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.588 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.11 21.41 8.09 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.659 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.6 146.63 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.7 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -90.56 110.64 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 0.0 111.422 -179.451 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.709 HG23 ' HG ' ' A' ' 145' ' ' LEU . 9.7 p -150.2 163.36 3.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.03 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.486 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 147.14 24.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.554 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.0 129.65 56.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.78 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -64.66 96.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.599 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.484 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 56.97 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.429 0.633 . . . . 0.0 111.686 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.0 m-20 -101.99 -48.75 4.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.776 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -82.06 160.6 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.725 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.585 ' CG1' HG22 ' A' ' 120' ' ' THR . 10.4 p -106.23 153.46 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.58 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.66 173.12 11.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.125 0.488 . . . . 0.0 111.389 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -70.82 163.15 27.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.904 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.709 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -79.8 -31.04 40.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.166 0.507 . . . . 0.0 109.741 178.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.25 -49.19 6.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.815 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 71.4 m -49.9 -38.04 34.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.318 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.786 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.5 OUTLIER -56.97 112.43 1.33 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 111.046 -179.692 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.06 171.73 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.95 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.77 149.98 37.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.93 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 152' ' ' VAL . 9.9 m -75.55 -32.06 24.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.074 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -103.29 -49.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.13 -28.03 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 59.04 41.98 19.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.008 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -129.07 141.15 51.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.995 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -64.11 151.19 43.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.678 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.7 mm? -104.47 162.71 13.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.689 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.96 171.26 15.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.311 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.464 HG23 ' C ' ' A' ' 11' ' ' GLY . 4.9 m -43.98 125.32 4.27 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.609 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.14 -22.49 38.23 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.769 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.471 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.6 t0 -68.55 131.3 45.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.772 0.32 . . . . 0.0 110.778 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.44 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.5 mt-10 -87.88 128.45 35.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.008 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.884 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -145.03 140.56 28.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.127 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.687 ' HB2' HG13 ' A' ' 172' ' ' VAL . 54.1 m-85 -98.09 132.49 43.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.556 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.78 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.9 tp -87.96 111.0 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.839 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.5 mmt -74.77 148.76 40.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.901 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.72 -28.06 67.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.056 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -97.58 34.6 1.81 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 60.5 p 53.53 80.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.432 ' HD3' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -156.17 130.63 8.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.811 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.884 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.6 mp -92.5 128.77 38.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.958 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.687 HG13 ' HB2' ' A' ' 164' ' ' TYR . 6.6 p -144.99 118.84 2.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.2 p -66.56 -172.87 0.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.656 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -77.15 -39.26 49.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.355 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.11 -59.04 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.521 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -74.22 -9.33 58.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.501 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 8.6 t80 -57.05 -66.13 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -63.87 -28.59 69.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.009 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.0 m -77.77 -21.72 51.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.223 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.16 -29.85 13.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.774 0.321 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' LYS . . . . . 0.428 ' HE2' ' CE1' ' A' ' 177' ' ' TYR . 0.1 OUTLIER -170.35 -178.22 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 179.999 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.67 161.49 37.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 60.76 111.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.865 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.0 m -124.01 152.36 66.64 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.128 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.5 -46.25 1.41 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.519 2.146 . . . . 0.0 112.356 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 t0 60.41 176.21 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.833 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.458 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 9.1 p -110.24 126.92 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.489 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.421 ' HE3' ' HB2' ' A' ' 8' ' ' MET . 0.0 OUTLIER -131.76 -163.06 1.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 162' ' ' GLU . 9.8 p -147.58 132.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.406 ' CG2' ' CD1' ' A' ' 163' ' ' PHE . 21.6 t -55.58 146.19 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.224 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.418 ' C ' HG23 ' A' ' 159' ' ' THR . . . -124.33 -174.77 14.16 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.371 -0.919 . . . . 0.0 112.908 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 50.9 mt-10 -56.64 137.39 77.49 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.558 0.218 . . . . 0.0 110.935 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.802 ' HB2' HG12 ' A' ' 134' ' ' VAL . 14.7 Cg_exo -67.01 136.99 43.03 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.498 2.132 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.417 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.7 OUTLIER -166.07 142.97 5.22 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.113 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.959 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.6 OUTLIER -116.28 173.89 6.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 111.443 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.44 ' HE2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.36 -38.74 81.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.669 -179.223 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 71.67 55.72 7.22 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.336 -0.935 . . . . 0.0 111.975 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.04 23.24 30.28 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.804 -0.713 . . . . 0.0 113.042 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -51.07 95.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.868 0.366 . . . . 0.0 110.738 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 3.1 m-85 -57.79 -35.25 70.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.828 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.07 176.12 43.43 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.485 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.756 ' HB3' HD22 ' A' ' 27' ' ' LEU . 74.1 m-20 -83.99 -30.79 25.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.844 0.354 . . . . 0.0 110.965 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.17 -31.83 73.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.66 -76.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 32.3 mm-40 -82.78 172.19 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.023 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -76.02 118.16 18.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.756 HD22 ' HB3' ' A' ' 22' ' ' ASP . 3.4 tp -95.71 165.15 12.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.939 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.68 144.21 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.178 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.437 HG22 ' HG ' ' A' ' 31' ' ' LEU . 20.2 m -109.19 106.76 16.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -82.74 101.64 11.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.263 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.1 166.04 28.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.155 -179.563 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.03 145.45 44.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.484 ' ND2' HG21 ' A' ' 70' ' ' ILE . 1.1 t30 -95.02 -167.68 1.67 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.841 HG23 ' HB2' ' A' ' 38' ' ' ALA . 6.2 t -82.35 58.6 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.924 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 pm0 45.26 -169.41 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.569 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 71' ' ' LEU . 4.4 t80 -91.9 -22.9 19.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.013 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -57.61 -20.52 33.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.841 ' HB2' HG23 ' A' ' 34' ' ' THR . . . -46.43 -29.52 1.76 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.801 0.334 . . . . 0.0 111.479 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.56 ' CB ' HD22 ' A' ' 71' ' ' LEU . . . -125.93 -172.87 2.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.131 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -80.76 88.03 5.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.26 -43.66 0.14 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.7 tp -54.3 135.45 16.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.773 0.32 . . . . 0.0 111.402 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.25 87.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.847 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -165.76 -45.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.902 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -99.27 92.2 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 162.89 -131.16 2.41 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 139.31 -132.62 5.75 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.472 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.55 130.04 12.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.828 0.347 . . . . 0.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.25 61.75 1.31 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.507 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -88.87 -132.5 4.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.561 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -108.84 -33.66 6.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.842 0.353 . . . . 0.0 110.876 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 8.1 ptt? -168.83 -52.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.87 -161.1 28.62 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.442 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m 60.35 102.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.793 0.33 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -105.37 -106.34 3.11 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.516 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 61.1 168.92 0.54 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.466 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 60' ' ' ILE . 0.2 OUTLIER -95.12 143.12 25.57 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.686 0.279 . . . . 0.0 110.86 179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.35 154.61 40.99 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.526 2.15 . . . . 0.0 112.352 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 57.27 28.9 15.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.923 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.636 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -94.64 134.9 24.49 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.031 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 60' ' ' ILE . 13.3 Cg_endo -57.45 125.97 20.48 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.459 2.106 . . . . 0.0 111.981 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.01 146.8 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.148 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.9 t -57.1 155.29 8.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -80.08 114.71 19.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.565 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.38 -59.06 0.38 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.466 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.7 p -96.94 161.31 13.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -91.8 75.62 5.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -178.15 134.0 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.896 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.636 ' CD2' HG21 ' A' ' 60' ' ' ILE . 7.1 p80 -63.94 153.4 37.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.484 HG21 ' ND2' ' A' ' 33' ' ' ASN . 10.3 mm -79.24 151.26 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.56 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -157.35 30.61 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -102.99 -178.98 3.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -35.52 8.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.678 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -106.18 107.2 18.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.683 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 37.4 mm -128.92 153.06 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 111.485 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.1 mp -108.6 110.33 21.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.147 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -90.68 126.55 36.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.247 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.769 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.69 165.73 31.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.963 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.667 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 57.07 34.63 25.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.108 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.87 40.18 9.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.088 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -177.53 169.03 2.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.943 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.411 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 34.6 p-80 -88.8 120.97 30.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.896 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.667 ' NE1' HD12 ' A' ' 79' ' ' LEU . 55.2 m95 -111.7 128.24 56.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.85 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.46 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.83 167.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.854 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 t -73.3 -39.5 65.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.748 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -91.08 -37.42 13.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.19 -31.53 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.958 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 28' ' ' ILE . 10.9 tp -65.97 85.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -156.1 161.38 40.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.922 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 147.04 40.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.1 m -69.41 -28.82 66.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.048 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.77 -60.19 1.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.9 m -58.69 -39.12 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.034 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 57.48 22.43 8.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.442 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.4 m -85.37 154.39 59.66 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.71 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.486 2.124 . . . . 0.0 112.204 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 95' ' ' VAL . 9.3 mp -111.12 57.88 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.728 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.2 43.19 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -157.43 -62.23 0.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.686 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.99 128.97 41.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.448 ' CB ' HG23 ' A' ' 28' ' ' ILE . 11.0 t -129.89 127.91 41.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 4.2 m-85 -111.48 171.94 7.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.731 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.498 ' HB3' HD22 ' A' ' 79' ' ' LEU . 11.7 p -149.5 137.24 20.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 110.973 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -169.44 123.97 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.842 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.99 17.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.613 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 60.86 38.31 17.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.831 0.348 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -156.18 156.29 33.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.862 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.9 p -78.0 120.72 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.118 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -124.79 151.56 45.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.944 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 24.4 p -103.32 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.436 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.06 -41.01 36.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.291 -179.653 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -43.53 -58.04 2.82 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.59 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -75.58 -20.49 58.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 20' ' ' PHE . 56.0 t80 -64.32 -35.31 80.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.013 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 33.4 m-85 -67.63 -44.69 77.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.036 0.446 . . . . 0.0 110.87 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -80.49 -32.55 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.314 -179.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -80.82 -56.59 4.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.341 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.432 ' CG ' ' CE1' ' A' ' 114' ' ' PHE . 5.4 m-85 -95.48 -43.06 8.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.155 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -66.58 -150.64 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.3 m -103.18 154.05 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.68 0.276 . . . . 0.0 110.71 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.445 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.0 OUTLIER -137.23 179.36 6.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 111.268 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 129' ' ' ILE . 49.8 t -78.85 141.73 37.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.079 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.15 20.3 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.438 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -49.36 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.893 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 19.9 p -111.22 -17.66 13.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 67.35 47.09 1.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.956 0.408 . . . . 0.0 111.097 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.11 -162.08 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.58 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -117.33 79.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.903 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.499 HD11 ' CA ' ' A' ' 122' ' ' CYS . 2.1 mp -59.53 139.09 89.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.525 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 73.9 Cg_exo -46.84 172.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.248 1.965 . . . . 0.0 111.989 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.418 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.3 Cg_endo -77.13 -55.02 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.305 2.003 . . . . 0.0 113.798 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.84 22.17 9.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.474 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.959 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.55 -166.85 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.521 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -122.77 111.68 31.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.967 0.413 . . . . 0.0 111.412 -179.672 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.753 HG23 ' HG ' ' A' ' 145' ' ' LEU . 14.1 p -148.74 162.72 5.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.493 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.02 137.97 34.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.897 0.38 . . . . 0.0 110.891 -179.832 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.65 173.09 6.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.748 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.669 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -142.21 134.4 27.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.931 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.876 ' CG ' HD13 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 39.65 -84.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.609 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 138' ' ' ALA . 10.7 t0 -144.33 41.08 1.35 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.815 0.34 . . . . 0.0 111.152 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.447 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . 10.8 m-85 -148.11 165.05 32.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.48 ' O ' HG13 ' A' ' 142' ' ' VAL . 14.6 p -115.51 121.11 66.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.669 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 51.0 m-85 -113.61 140.1 48.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.283 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 3.3 m80 -58.87 150.4 24.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.802 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.753 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.6 OUTLIER -61.74 -21.92 64.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.179 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.19 -49.14 6.54 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.598 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 63.9 m -57.04 -40.77 77.42 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.916 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.779 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.2 OUTLIER -56.85 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.119 -179.698 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.15 172.8 4.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.795 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.7 t -82.13 150.25 27.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.208 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 29.1 m -73.62 -31.89 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.304 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 20.5 t -99.46 -57.57 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.467 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.2 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.104 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? 60.0 44.5 13.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.95 139.63 52.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.622 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.9 mp0 -66.58 166.31 13.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.428 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.722 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.2 mm? -122.22 166.42 14.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.396 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 169.16 19.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.029 0.442 . . . . 0.0 111.472 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.434 HG23 ' N ' ' A' ' 12' ' ' GLU . 7.4 m -43.79 129.29 5.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.654 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 92.71 -21.36 39.37 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.882 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.45 ' OD1' HD12 ' A' ' 157' ' ' LEU . 6.9 t70 -73.91 130.96 40.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.835 0.35 . . . . 0.0 110.791 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.444 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 14.4 mt-10 -87.99 127.07 35.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.019 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.804 ' CD2' HD23 ' A' ' 171' ' ' LEU . 25.9 p90 -134.62 179.07 6.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.419 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.731 ' HB2' HG13 ' A' ' 172' ' ' VAL . 16.1 m-85 -133.08 115.04 14.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.333 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.876 HD13 ' CG ' ' A' ' 139' ' ' GLN . 5.9 tt -87.97 110.78 20.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 110.595 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' MET . . . . . 0.428 ' HE2' HG11 ' A' ' 172' ' ' VAL . 18.4 mmt -75.96 164.33 26.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.24 -28.13 62.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.171 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -97.38 28.92 3.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.54 33.96 23.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.987 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -98.39 98.55 9.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.804 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.5 OUTLIER -66.97 133.11 49.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.788 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.752 HG23 ' OD2' ' A' ' 176' ' ' ASP . 2.7 p -145.18 140.26 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.0 m -71.46 -178.43 2.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.965 0.412 . . . . 0.0 111.313 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.11 -31.15 22.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.885 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.57 25.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.451 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.752 ' OD2' HG23 ' A' ' 172' ' ' VAL . 8.1 p-10 -83.0 4.15 27.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.648 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.524 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 27.9 t80 -61.77 -66.14 0.58 Allowed 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.08 0.467 . . . . 0.0 110.966 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.03 -28.78 0.74 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.826 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -31.53 57.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.367 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.1 -31.74 12.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.514 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 64.42 174.28 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.868 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.839 0.352 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 t -70.94 106.25 3.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.936 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -151.23 31.63 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 4' ' ' VAL . 6.5 m -110.12 82.03 2.4 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.061 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.53 -37.59 7.15 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.547 2.165 . . . . 0.0 112.306 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -152.54 80.12 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.907 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 ' N ' ' A' ' 8' ' ' MET . 13.2 p -115.36 159.13 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.485 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -145.08 179.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.605 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.467 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.7 p -155.03 135.38 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.358 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.453 HG23 ' CD1' ' A' ' 163' ' ' PHE . 43.9 t -60.42 146.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.45 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.473 ' C ' HG23 ' A' ' 159' ' ' THR . . . -130.14 -160.72 10.18 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.777 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 4.5 mm-40 -64.0 132.02 95.14 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.579 0.228 . . . . 0.0 110.832 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.555 ' HB2' HG12 ' A' ' 134' ' ' VAL . 21.9 Cg_exo -63.16 143.64 90.48 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.311 2.008 . . . . 0.0 112.337 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.13 155.01 11.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.372 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.915 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.1 OUTLIER -144.09 173.88 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.138 0.494 . . . . 0.0 111.697 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -68.38 0.24 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.144 -179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 85.49 63.32 1.57 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.268 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -109.45 -70.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.543 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.4 ' CA ' ' HB3' ' A' ' 131' ' ' PRO . 4.2 tt0 72.42 84.01 0.13 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.908 0.385 . . . . 0.0 110.793 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.483 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.4 OUTLIER -57.28 -167.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.926 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -177.51 179.69 48.08 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.581 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.635 ' HB3' HD22 ' A' ' 27' ' ' LEU . 11.6 m-20 -81.32 -30.03 34.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 110.955 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -58.26 -26.26 62.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -56.99 -68.56 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.076 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 6.5 mm-40 -103.42 176.02 5.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.939 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 121.8 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -95.65 162.08 13.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.804 HD11 ' C ' ' A' ' 99' ' ' GLU . 7.4 pt -62.84 158.28 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 m -123.8 106.95 10.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.827 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.04 101.86 6.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -144.68 162.22 37.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 6.3 mp0 -81.61 156.99 24.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.892 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -107.5 171.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.2 t -97.89 37.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.405 ' NE2' HG22 ' A' ' 70' ' ' ILE . 4.3 mp0 -127.02 163.09 24.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -169.76 -42.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -142.08 80.26 1.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.965 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -143.55 93.42 2.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.139 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.6 107.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.069 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.2 79.32 0.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -107.96 -115.57 3.93 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.523 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.401 ' O ' HG22 ' A' ' 42' ' ' ILE . 41.8 mm -82.3 80.56 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.825 0.345 . . . . 0.0 110.963 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 60.33 110.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -176.58 87.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -102.8 97.42 7.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.902 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.06 111.62 3.91 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 59.99 95.55 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.8 p -104.57 159.92 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.874 0.369 . . . . 0.0 110.905 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.75 -58.76 0.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.508 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.57 169.76 43.93 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.477 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -37.73 88.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.935 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.6 ptp -169.45 81.45 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.45 -44.95 49.58 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.475 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.3 t -146.29 93.02 2.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.795 0.331 . . . . 0.0 110.857 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 144.3 -145.6 15.3 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.488 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.55 117.44 0.53 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.579 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.93 83.01 65.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 110.929 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.99 168.73 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.546 2.164 . . . . 0.0 112.232 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 57.88 30.25 18.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.574 HD13 ' CG ' ' A' ' 69' ' ' HIS . 8.8 tt -105.01 136.65 19.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.975 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.71 125.88 20.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.351 2.034 . . . . 0.0 111.799 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.87 134.51 38.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.262 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.433 ' HB2' HG12 ' A' ' 70' ' ' ILE . 3.2 t -59.27 141.82 53.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.774 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -63.38 114.84 4.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.132 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.91 26.37 45.57 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.025 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -128.67 -178.88 4.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.798 0.333 . . . . 0.0 110.832 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -134.99 35.61 3.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.951 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.593 ' HG3' ' CE1' ' A' ' 69' ' ' HIS . 16.2 tt0 -151.7 -88.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.593 ' CE1' ' HG3' ' A' ' 68' ' ' GLN . 0.6 OUTLIER 175.75 -179.18 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.758 0.313 . . . . 0.0 110.958 179.908 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.45 HG13 ' CD2' ' A' ' 82' ' ' HIS . 3.2 mm -103.33 150.88 6.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.022 0.439 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.83 37.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.85 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -109.38 170.35 8.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.912 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -70.05 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.429 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -90.3 140.23 29.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.7 mm -141.56 151.24 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.16 106.96 17.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.496 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -90.83 115.48 27.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.978 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -152.71 167.03 30.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.794 HD21 ' SG ' ' A' ' 101' ' ' CYS . 1.6 mt 57.5 35.34 25.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 62.59 35.52 14.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.032 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -172.47 176.11 3.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.027 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.45 ' CD2' HG13 ' A' ' 70' ' ' ILE . 48.7 p-80 -95.43 117.95 31.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.706 ' NE1' HD12 ' A' ' 79' ' ' LEU . 61.5 m95 -110.72 125.79 53.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.731 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.93 175.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 t -80.01 -40.55 27.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.484 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -91.12 -19.71 22.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.27 17.65 9.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.306 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 83' ' ' TRP . 10.2 tp -127.93 73.59 1.47 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -127.26 150.49 49.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -60.48 126.42 27.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.799 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.4 m -58.48 -20.8 48.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.472 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -102.87 -63.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.765 0.317 . . . . 0.0 111.347 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.8 m -68.98 -30.18 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.25 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 57.87 22.35 8.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.028 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.9 m -87.23 152.21 52.45 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.177 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.93 118.97 5.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.24 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.58 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.3 mp -113.17 56.41 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.42 28.62 3.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.202 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.804 ' C ' HD11 ' A' ' 28' ' ' ILE . 3.4 mm-40 -135.09 -46.54 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.781 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.9 mtm180 -148.75 138.02 21.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.794 ' SG ' HD21 ' A' ' 79' ' ' LEU . 53.5 t -112.96 156.02 23.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.453 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -158.14 120.72 3.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.4 t -112.93 152.96 28.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.75 123.95 8.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.56 -104.99 1.32 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.443 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -67.72 0.89 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.788 0.327 . . . . 0.0 110.825 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.7 m -70.08 -176.97 1.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.5 p -110.57 116.0 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.096 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -113.86 120.9 42.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.447 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.4 p -63.98 173.99 1.66 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.847 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.453 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.06 -30.0 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 22.6 t0 -53.33 -58.01 8.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.312 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -71.93 -20.72 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.079 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.483 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 8.6 t80 -62.04 -27.22 68.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 2.3 m-85 -79.15 -44.56 21.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt -85.41 -62.39 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.466 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -58.16 -52.09 67.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.762 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 7.3 m-85 -88.46 -43.03 11.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.347 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.41 -159.9 17.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.416 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -103.09 142.92 33.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.786 0.327 . . . . 0.0 110.827 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 173.87 11.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.074 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.2 138.18 58.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.55 29.59 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.122 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.18 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.923 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 10.3 p -109.9 8.03 24.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.325 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 57.96 29.86 18.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.815 0.34 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.3 tp -87.55 143.82 27.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.787 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.65 103.69 1.24 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.698 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.608 ' CG2' HD11 ' A' ' 15' ' ' LEU . 53.8 mt -60.76 134.34 92.18 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.5 0.19 . . . . 0.0 110.489 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.515 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 80.4 Cg_exo -45.99 172.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.507 2.138 . . . . 0.0 112.54 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.4 ' HB3' ' CA ' ' A' ' 19' ' ' GLU . 7.3 Cg_exo -73.72 -55.37 0.09 OUTLIER 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.856 2.37 . . . . 0.0 113.393 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -126.14 22.05 7.31 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.617 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.915 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -53.57 -178.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.492 179.836 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.52 111.96 33.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.908 0.385 . . . . 0.0 111.123 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.713 HG23 ' HG ' ' A' ' 145' ' ' LEU . 7.1 p -157.09 164.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.952 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.505 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.59 138.18 34.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.493 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.72 130.08 52.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.785 -179.603 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.435 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.86 96.0 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 37.64 -88.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.1 m-20 -79.2 -34.27 43.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.789 -176.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.444 ' N ' ' CD1' ' A' ' 141' ' ' PHE . 1.3 m-85 -115.71 178.25 4.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 112.23 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 9.9 p -113.62 152.19 15.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.598 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -132.06 174.99 9.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.167 0.508 . . . . 0.0 111.561 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -81.48 166.63 20.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.014 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.713 ' HG ' HG23 ' A' ' 135' ' ' VAL . 3.6 mp -81.19 -33.42 33.01 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.32 -49.31 6.42 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.891 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 65.7 m -51.53 -35.06 38.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.201 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.642 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.92 117.97 4.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.221 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.34 -176.95 1.69 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.885 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.3 t -100.36 150.08 22.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.957 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 152' ' ' VAL . 8.4 m -69.33 -27.47 34.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 151' ' ' VAL . 21.4 t -104.99 -55.69 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.351 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.3 m -65.96 -27.92 68.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.979 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 17.9 tttt 58.04 31.94 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -123.97 144.18 49.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.015 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.525 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.0 mt-30 -61.92 162.41 9.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.322 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.705 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.4 mm? -113.99 165.22 12.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.47 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.404 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 168.75 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.489 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.473 HG23 ' C ' ' A' ' 11' ' ' GLY . 5.3 m -43.46 128.42 4.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.67 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.63 -25.35 23.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.681 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.467 ' C ' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -66.39 129.69 40.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.784 0.326 . . . . 0.0 110.758 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.45 ' HA ' HG23 ' A' ' 9' ' ' VAL . 20.9 mt-10 -87.89 124.17 33.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.877 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.1 p90 -140.18 147.72 40.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.012 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.694 ' HB2' HG13 ' A' ' 172' ' ' VAL . 36.8 m-85 -102.16 159.72 15.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.417 HD13 ' HE1' ' A' ' 8' ' ' MET . 1.1 tp -112.86 110.94 21.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.757 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 13.0 mmt -74.63 166.25 23.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.029 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -60.62 -26.96 67.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -96.95 27.93 3.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.073 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 57.46 40.02 27.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.068 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -104.03 141.54 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.877 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -93.3 130.86 38.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.694 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.1 p -145.06 123.68 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.073 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 26.4 m -56.51 -170.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.95 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -74.4 -57.68 3.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.55 82.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.073 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -65.46 -25.7 67.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.957 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.456 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 9.5 t80 -54.67 -66.13 0.46 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.01 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.78 -32.83 73.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 57.7 m -67.4 -31.56 71.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -80.55 -51.96 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.104 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.35 -67.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' GLN . . . . . 0.451 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 5.3 mt-30 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.935 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.805 0.336 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 m -80.56 164.98 22.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.895 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.59 31.48 0.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 4' ' ' VAL . 8.4 m -131.21 81.26 66.42 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.161 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.56 -168.02 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.61 2.207 . . . . 0.0 112.269 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -59.73 102.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.493 HG22 ' N ' ' A' ' 8' ' ' MET . 11.9 p -119.76 158.63 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.606 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -154.49 -178.17 6.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.524 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.8 p -155.05 136.29 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.004 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.448 HG21 ' HB3' ' A' ' 157' ' ' LEU . 30.1 t -52.88 146.3 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.903 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.742 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -140.86 -144.14 4.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.817 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 29.8 mt-10 -76.59 120.14 80.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.552 0.215 . . . . 0.0 110.808 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.918 ' HB2' HG12 ' A' ' 134' ' ' VAL . 20.7 Cg_exo -62.82 140.08 78.06 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.344 2.029 . . . . 0.0 112.127 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.36 164.55 34.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -138.0 173.44 11.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -29.18 68.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.809 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.14 87.31 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.619 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.33 124.3 1.18 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.569 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -107.08 22.78 15.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.709 0.29 . . . . 0.0 110.865 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 63.3 -179.9 0.15 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.38 133.04 6.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.532 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.488 ' HB3' HD22 ' A' ' 27' ' ' LEU . 65.5 m-20 -58.31 -30.53 66.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.836 0.35 . . . . 0.0 110.994 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -59.71 -28.64 67.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -58.52 -68.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.443 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 1.6 mm-40 -95.4 176.08 6.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.748 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -76.98 144.18 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.84 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.8 tp -112.01 165.14 12.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.931 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.949 HD12 HD21 ' A' ' 88' ' ' LEU . 35.5 mm -62.79 157.54 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.034 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.485 ' N ' HG22 ' A' ' 28' ' ' ILE . 3.6 m -124.75 106.95 10.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.924 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 101.88 12.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.546 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.578 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -139.71 149.62 43.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.945 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.21 145.31 37.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.493 ' O ' HG22 ' A' ' 34' ' ' THR . 2.0 m120 -108.91 -26.51 10.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.031 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 33' ' ' ASN . 15.0 t 45.31 36.0 2.09 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -113.78 34.69 4.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.825 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.555 ' CZ ' HD13 ' A' ' 42' ' ' ILE . 37.1 t80 -59.58 -69.21 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -69.85 78.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -115.74 -39.38 3.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.15 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -175.13 107.59 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.127 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m120 62.76 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.025 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.1 -114.98 4.2 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.508 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.641 ' N ' HD12 ' A' ' 42' ' ' ILE . 2.5 mp -84.31 -46.58 17.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.38 162.79 26.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.908 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -142.16 156.8 45.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -73.17 148.94 43.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -138.03 154.11 22.62 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.549 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -177.99 -61.13 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.53 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -165.63 -74.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.774 0.321 . . . . 0.0 110.826 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.99 -67.5 0.71 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.511 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 173.06 -153.82 19.17 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.576 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -105.17 166.48 10.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.869 0.366 . . . . 0.0 110.883 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 97.7 mmm -90.34 120.94 31.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.862 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.76 28.55 73.02 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.452 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 60.38 168.98 0.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.807 0.337 . . . . 0.0 110.942 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -149.94 -175.59 22.27 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.456 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 135.99 -160.75 24.71 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.446 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.0 89.56 2.5 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 110.848 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.35 164.59 30.03 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.459 2.106 . . . . 0.0 112.187 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.88 30.63 20.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.749 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.437 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -104.76 135.3 19.32 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.067 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 14.8 Cg_endo -58.0 125.93 20.08 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.412 2.075 . . . . 0.0 112.035 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.17 138.67 31.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -57.43 164.19 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.869 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.469 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -84.29 114.61 21.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.377 179.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.16 -82.1 0.35 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.482 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.0 p -91.34 154.2 19.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 110.94 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -75.8 88.86 2.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -178.53 135.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.531 ' CD2' HD23 ' A' ' 71' ' ' LEU . 14.7 p-80 -72.23 145.28 48.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.01 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.461 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -72.27 153.35 7.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.531 HD23 ' CD2' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -174.16 36.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -112.07 138.14 49.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.815 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -34.06 63.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.192 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -106.55 107.71 18.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.052 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.422 HG22 ' N ' ' A' ' 76' ' ' LEU . 47.9 mm -123.5 153.44 29.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.078 0.466 . . . . 0.0 111.258 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.422 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.0 mp -115.15 106.94 14.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.167 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 46.0 tttt -90.66 123.11 34.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.026 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.19 167.04 31.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.066 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.748 HD23 ' HD2' ' A' ' 26' ' ' ARG . 1.7 mt 57.29 34.12 24.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.125 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.84 34.3 14.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.79 171.98 5.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.058 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -89.72 117.94 28.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.852 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.71 ' NE1' HD12 ' A' ' 79' ' ' LEU . 47.4 m95 -111.44 126.08 54.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.848 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.461 ' CD2' HD11 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -52.53 143.66 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.931 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.3 p -57.59 -37.58 73.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -91.08 -12.77 34.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.261 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 61.5 m -104.95 22.44 15.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.687 0.28 . . . . 0.0 111.152 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.949 HD21 HD12 ' A' ' 28' ' ' ILE . 18.2 tp -118.88 30.63 7.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.859 0.362 . . . . 0.0 110.864 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.6 153.27 20.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.871 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 5.4 t -59.33 147.02 37.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.74 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.77 -28.43 66.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.294 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -105.03 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 0.0 111.253 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.576 ' HB2' HG22 ' A' ' 95' ' ' VAL . 20.2 m -58.82 -29.44 66.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.166 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 57.77 21.8 7.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.134 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.576 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.8 m -90.46 156.61 45.44 Favored Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.166 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 118.94 5.77 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.443 2.095 . . . . 0.0 112.245 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.766 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.3 mp -101.29 72.27 1.42 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.5 30.6 3.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.084 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -146.6 -47.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.676 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.3 158.35 44.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.776 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.575 ' HB3' HD11 ' A' ' 28' ' ' ILE . 26.7 p -141.85 175.95 9.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.034 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' CE2' ' A' ' 114' ' ' PHE . 1.1 t80 -162.72 152.14 15.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.773 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -134.22 135.04 42.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HG3' ' CZ ' ' A' ' 118' ' ' PHE . 28.5 mmt-85 -147.95 124.0 10.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.31 1.6 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -166.29 -44.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 110.872 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.05 179.84 1.41 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.929 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.456 HG13 ' O ' ' A' ' 108' ' ' VAL . 12.4 p -108.25 123.0 63.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.008 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.42 169.53 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.866 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' CYS . . . . . 0.766 ' HB3' HD21 ' A' ' 97' ' ' LEU . 21.0 p -121.85 168.21 12.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.634 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 8.6 mttp -78.14 -26.75 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -54.58 -49.77 69.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.265 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -83.94 -20.53 32.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 20' ' ' PHE . 9.0 t80 -61.41 -30.5 70.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.977 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.446 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.1 m-85 -69.19 -45.94 68.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.758 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -85.44 -60.77 1.93 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.594 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.27 -52.83 63.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.168 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 5.0 m-85 -84.29 -43.06 15.19 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -64.3 -136.96 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.514 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.5 m -103.06 153.97 19.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.732 0.301 . . . . 0.0 110.789 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.76 162.27 41.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.266 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.3 t -57.47 139.33 53.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.978 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.73 29.46 2.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.17 -58.15 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 15.1 p -107.67 10.37 29.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.358 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.22 36.24 27.12 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.783 0.325 . . . . 0.0 110.973 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 15.3 tp -99.73 137.4 38.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.939 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.99 131.74 36.52 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.658 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.7 HG22 HD11 ' A' ' 15' ' ' LEU . 12.0 mt -95.09 128.22 39.74 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.395 0.141 . . . . 0.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.628 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 82.4 Cg_exo -42.73 168.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.615 2.21 . . . . 0.0 112.614 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.419 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 23.2 Cg_exo -65.46 -55.36 0.46 Allowed 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.75 2.3 . . . . 0.0 113.843 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.859 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.52 21.49 7.8 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.21 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.664 HE21 HG23 ' A' ' 129' ' ' ILE . 1.1 pp0? -61.07 136.94 58.23 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.376 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.918 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -71.91 108.73 3.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.009 0.433 . . . . 0.0 111.054 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.0 p -144.83 159.33 14.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.906 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.489 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.79 136.22 37.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.03 164.31 12.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.033 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.642 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -106.41 96.71 6.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.667 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.438 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.92 -86.24 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.361 0.6 . . . . 0.0 111.746 -179.789 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.97 -49.18 4.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.789 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -84.25 161.26 20.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.597 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.2 p -103.89 152.21 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.553 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -128.54 175.13 8.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.129 0.49 . . . . 0.0 111.654 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.82 163.4 21.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.041 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -81.23 -31.71 33.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.734 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -49.28 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.789 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' CYS . . . . . 0.419 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 78.4 m -52.48 -32.35 39.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.991 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.718 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -57.05 119.82 6.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.034 -179.822 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.27 -177.04 1.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.975 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.9 t -101.47 150.09 23.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.03 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 152' ' ' VAL . 24.6 m -68.81 -26.87 33.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.335 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 151' ' ' VAL . 27.3 t -107.03 -56.41 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.25 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.1 m -65.88 -28.13 68.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.101 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.11 34.9 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -126.42 142.34 51.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.969 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.412 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.38 152.79 16.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.262 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.699 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.3 mm? -109.5 107.96 18.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ALA . . . . . 0.424 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -91.3 168.06 11.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.475 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' THR . . . . . 0.742 HG23 ' HA2' ' A' ' 11' ' ' GLY . 6.9 m -40.73 132.33 2.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.83 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.07 -26.99 16.32 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.618 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.524 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.1 t0 -67.8 128.92 38.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.331 . . . . 0.0 110.84 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.473 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.3 mt-10 -87.99 114.5 24.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.825 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.805 ' CD2' HD23 ' A' ' 171' ' ' LEU . 11.5 p90 -128.16 143.62 51.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.015 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.517 ' HB2' HG13 ' A' ' 172' ' ' VAL . 11.1 m-85 -100.13 162.43 12.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.748 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.642 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -115.04 110.85 20.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.742 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.8 mmt -75.4 164.47 26.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.015 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -59.16 -26.26 64.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.129 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.71 27.09 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.099 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.0 46.76 18.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.922 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 0.1 OUTLIER -110.88 146.54 36.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.805 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -98.31 128.89 44.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.6 p -145.07 130.18 13.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 55.5 m -53.0 -179.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.108 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.413 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 0.5 OUTLIER -67.95 -61.03 2.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.32 72.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -63.58 -26.96 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.002 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -55.07 -66.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.007 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -53.99 -26.74 27.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.23 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.1 m -78.48 -30.16 47.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.976 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -93.74 -27.25 16.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.233 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm 63.28 173.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.885 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.79 160.29 15.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.878 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -176.3 -175.97 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.0 t -106.21 88.04 2.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 164.25 35.36 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.565 2.177 . . . . 0.0 112.285 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 60.83 87.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.553 HG23 ' CE1' ' A' ' 164' ' ' TYR . 14.0 p -126.04 158.81 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.1 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.487 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.75 -175.09 3.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.636 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.401 HG23 ' HA ' ' A' ' 162' ' ' GLU . 4.2 p -154.39 150.8 11.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.156 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 161' ' ' ASP . 38.4 t -67.39 146.25 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.706 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.66 -162.03 10.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.388 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -71.5 145.37 90.14 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.568 0.223 . . . . 0.0 110.63 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.5 Cg_endo -83.02 130.0 5.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.58 163.73 37.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.395 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.564 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.7 OUTLIER -144.08 173.78 11.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.173 0.511 . . . . 0.0 111.621 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.534 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -38.27 87.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.428 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.745 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 64.24 81.54 0.11 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.65 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.72 -140.8 5.56 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.248 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 179.68 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.405 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 63.11 144.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.933 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 -160.45 8.9 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.534 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -83.98 -25.32 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.694 0.283 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -54.09 -26.64 28.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.245 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.43 -75.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.059 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 18.6 tp10 -101.79 163.5 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.867 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ptp85 -75.9 100.01 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.594 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.1 tp -63.33 165.21 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.808 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.0 pt -62.87 138.58 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.14 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.431 HG22 ' HG ' ' A' ' 31' ' ' LEU . 48.5 m -105.86 106.93 17.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HE ' HD11 ' A' ' 76' ' ' LEU . 1.1 tpt180 -78.34 101.69 7.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.394 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HG ' HG22 ' A' ' 29' ' ' THR . 0.3 OUTLIER -145.73 164.92 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.007 -179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.451 ' CG ' ' CE1' ' A' ' 74' ' ' PHE . 19.6 mt-10 -90.26 157.02 17.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -109.73 -29.41 8.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.53 ' O ' HG22 ' A' ' 34' ' ' THR . 22.5 m 62.18 31.41 17.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -115.86 71.71 0.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -105.39 31.29 5.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -158.53 79.78 0.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.927 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.53 -47.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.528 ' HB3' ' CD2' ' A' ' 71' ' ' LEU . . . -147.02 125.76 12.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.012 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m120 64.25 -78.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.2 -89.14 0.65 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.464 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.475 HG22 ' N ' ' A' ' 43' ' ' ASP . 46.9 mm -82.08 158.47 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.794 0.33 . . . . 0.0 110.96 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.475 ' N ' HG22 ' A' ' 42' ' ' ILE . 24.4 m-20 -97.3 39.7 1.18 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -143.9 80.16 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.881 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -91.22 -31.39 16.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.855 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -72.79 131.96 16.75 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.484 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.74 -40.76 2.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.536 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 p -104.92 -178.56 3.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.925 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -83.06 -83.85 0.88 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.51 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.08 29.89 6.97 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.2 t60 60.47 169.11 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -133.1 163.02 30.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.63 55.9 2.09 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.51 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.63 -171.28 0.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.768 0.318 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 158.11 -30.99 0.49 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.454 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.32 148.21 11.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.534 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.67 86.25 12.55 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.733 0.302 . . . . 0.0 110.875 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -51.71 165.82 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.463 2.109 . . . . 0.0 112.247 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.65 30.8 20.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.81 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.442 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.1 tp -108.91 134.92 20.2 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.442 ' HD2' HD12 ' A' ' 60' ' ' ILE . 26.2 Cg_endo -63.06 125.92 16.87 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.347 2.031 . . . . 0.0 112.163 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.75 147.36 26.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.2 t -59.01 154.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.905 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.501 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.86 114.81 21.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.575 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.7 -53.37 0.62 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.43 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 19.3 p -103.61 -178.99 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.767 0.318 . . . . 0.0 110.876 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.03 76.56 1.01 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.76 131.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.444 ' CD2' HD23 ' A' ' 71' ' ' LEU . 12.0 p-80 -63.97 148.14 50.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.437 ' HA ' HD13 ' A' ' 70' ' ' ILE . 5.7 mm -77.08 153.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.01 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.528 ' CD2' ' HB3' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -172.64 35.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.832 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -104.88 179.11 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.86 -68.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.451 ' CE1' ' CG ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -80.99 115.96 20.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.441 HG22 ' N ' ' A' ' 76' ' ' LEU . 44.9 mm -123.2 154.93 29.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.301 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.441 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.59 107.59 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.264 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -90.77 122.44 33.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.063 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.78 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.88 158.29 30.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.173 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.63 HD22 ' OG ' ' A' ' 103' ' ' SER . 0.6 OUTLIER 58.19 37.46 26.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.157 179.862 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 61.67 35.71 16.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.074 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -174.39 169.98 3.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.863 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 34.4 p80 -89.33 125.31 35.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.961 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.658 ' CB ' HD13 ' A' ' 88' ' ' LEU . 58.6 m95 -113.65 125.36 54.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 171.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.063 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.05 -39.83 28.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -90.97 -28.26 18.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.988 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 79.1 m -71.96 -28.96 63.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.049 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.685 HD21 HG21 ' A' ' 28' ' ' ILE . 11.2 tp -79.59 82.83 5.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -137.63 150.59 47.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.4 t -64.25 130.06 42.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.789 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -23.49 52.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.491 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.13 -63.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.787 0.327 . . . . 0.0 111.226 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.449 ' HB2' HG22 ' A' ' 95' ' ' VAL . 34.0 m -66.54 -33.07 74.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.172 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 57.08 22.63 7.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.051 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.499 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.9 m -87.85 152.15 50.81 Favored Pre-proline 0 N--CA 1.453 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.227 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -57.24 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.504 2.136 . . . . 0.0 112.169 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.645 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.2 mp -108.86 64.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.746 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.97 29.42 3.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.808 ' C ' HD11 ' A' ' 28' ' ' ILE . 23.0 mm-40 -135.11 -46.51 0.71 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.594 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.05 173.48 11.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.692 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.5 t -156.94 156.04 32.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.017 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.472 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -155.96 136.09 12.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.746 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 2.0 p -151.03 174.12 13.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.009 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -177.2 123.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.29 -95.55 1.86 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.535 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -142.19 38.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.906 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 0.7 OUTLIER -152.65 177.96 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.538 HG13 ' O ' ' A' ' 108' ' ' VAL . 11.3 p -149.13 115.99 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.187 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 107' ' ' SER . 0.4 OUTLIER -122.15 159.89 26.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.2 p -71.53 160.22 33.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.656 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 ttmt -56.94 -45.12 82.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.074 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.438 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 30.1 t70 -58.91 -29.5 67.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.107 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -84.1 -26.07 29.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.318 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 36.7 t80 -66.8 -39.06 87.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 112' ' ' ASP . 7.5 m-85 -65.38 -39.51 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.1 tttp -84.13 -30.12 26.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.119 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.9 mmm-85 -82.09 -53.79 5.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.192 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.25 -42.99 11.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.5 167.7 53.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.419 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 33.0 m -58.5 150.27 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.756 0.312 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -145.49 163.31 35.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.051 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HB2' HD11 ' A' ' 129' ' ' ILE . 48.6 t -72.8 130.7 41.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.88 28.01 4.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.106 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -54.62 1.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 26.8 p -111.08 -22.61 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 69.67 69.81 0.24 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.11 -166.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.792 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -103.5 86.95 0.55 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.557 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.752 HG23 HE21 ' A' ' 133' ' ' GLN . 16.3 mt -65.94 126.28 91.53 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.455 0.169 . . . . 0.0 110.833 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.592 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.4 Cg_exo -51.49 -178.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.233 1.955 . . . . 0.0 111.959 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 64.9 Cg_endo -77.24 -53.25 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.298 1.998 . . . . 0.0 113.901 -179.126 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.745 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.94 21.83 9.77 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 0.785 ' OE1' HD11 ' A' ' 145' ' ' LEU . 1.0 OUTLIER -55.49 145.33 23.14 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.365 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.898 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -87.79 108.9 18.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.963 0.411 . . . . 0.0 110.862 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.69 HG23 ' HG ' ' A' ' 145' ' ' LEU . 11.4 p -150.5 159.82 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.078 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ARG . . . . . 0.507 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 137.55 35.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.83 130.67 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.975 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -70.71 96.65 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.748 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.449 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 55.31 -86.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.386 0.612 . . . . 0.0 111.797 -179.773 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.414 ' OD2' ' CZ ' ' A' ' 141' ' ' PHE . 5.5 p-10 -99.6 -47.56 5.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.723 -178.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.676 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.5 m-85 -79.26 163.24 25.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.95 133.05 61.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' TYR . . . . . 0.628 ' O ' HG21 ' A' ' 135' ' ' VAL . 5.0 m-85 -111.06 171.45 7.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.05 0.452 . . . . 0.0 111.344 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 41.1 m80 -99.52 140.01 34.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.844 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.898 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.73 -20.07 45.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.471 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.01 -36.49 14.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.266 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 14.27 32.39 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.871 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 42.5 t80 -104.05 102.31 12.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.71 0.29 . . . . 0.0 110.657 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -156.86 -176.92 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.26 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -92.23 150.04 21.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 152' ' ' VAL . 16.8 m -65.59 -26.7 39.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.315 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -104.43 -56.28 5.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.345 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 20.3 m -65.91 -28.12 68.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.074 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 30.0 7.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.13 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -119.14 153.05 35.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLN . . . . . 0.424 ' C ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -68.24 154.08 42.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.708 ' N ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -115.9 137.46 52.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -109.34 161.28 15.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.039 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.7 t -46.23 130.28 10.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.372 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 109.34 -34.36 5.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.591 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' ' 10' ' ' VAL . 2.2 t0 -65.17 130.29 42.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.722 0.296 . . . . 0.0 110.784 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 48.8 mt-10 -87.96 119.65 28.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' PHE . . . . . 0.547 ' CD2' HD23 ' A' ' 171' ' ' LEU . 5.7 p90 -134.01 147.57 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' TYR . . . . . 0.553 ' CE1' HG23 ' A' ' 7' ' ' VAL . 30.9 m-85 -100.59 147.3 26.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.673 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' LEU . . . . . 0.547 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -105.41 114.19 28.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.5 mmt -69.39 174.49 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -66.81 -29.08 68.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.028 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -97.74 29.8 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.028 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.86 33.95 23.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.949 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.503 ' HG2' HG11 ' A' ' 151' ' ' VAL . 1.4 tpt180 -88.57 132.73 34.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' LEU . . . . . 0.871 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -84.94 121.01 27.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 172' ' ' VAL . . . . . 0.539 HG23 ' HB3' ' A' ' 176' ' ' ASP . 14.6 p -145.02 121.56 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.124 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 56.1 m -54.88 -174.37 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.856 0.36 . . . . 0.0 111.084 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -69.44 -60.94 2.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.15 -38.96 84.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.021 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ASP . . . . . 0.539 ' HB3' HG23 ' A' ' 172' ' ' VAL . 13.1 m-20 -59.25 -24.77 63.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -54.77 -63.72 1.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -49.18 -27.9 3.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.304 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 -25.33 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.95 -20.55 20.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.518 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.48 -177.58 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.836 0.351 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 179.989 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 8' ' ' MET . 13.5 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.852 0.358 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.49 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.74 -179.96 6.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.682 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.5 p -155.06 137.0 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.115 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.413 HG21 ' CB ' ' A' ' 157' ' ' LEU . 48.1 t -57.88 146.14 8.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.565 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.681 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -133.62 -151.11 6.44 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.782 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -71.8 122.57 87.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.446 0.165 . . . . 0.0 110.954 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.0 Cg_exo -64.44 142.92 80.62 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.328 2.019 . . . . 0.0 112.149 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.04 158.43 14.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.851 HD11 HG22 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -129.2 173.31 10.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.155 0.502 . . . . 0.0 111.267 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -37.84 81.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.932 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.754 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.01 79.62 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.552 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -145.55 -55.35 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 64.19 29.48 13.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.729 0.299 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 58.93 -168.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.973 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -148.99 125.3 2.0 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -59.9 -31.53 69.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.51 -30.23 70.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.46 -74.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 5.7 tp10 -78.2 151.35 33.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.977 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -76.08 101.96 5.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.875 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 100' ' ' ARG . 1.7 tp -73.92 165.13 25.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.784 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 6.0 pt -62.86 137.61 24.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -104.34 106.89 17.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD2' HD12 ' A' ' 28' ' ' ILE . 0.0 OUTLIER -83.1 101.77 11.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.469 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.576 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.4 157.31 44.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.001 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.08 116.88 18.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.6 163.71 23.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.5 t -107.4 31.57 5.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -104.1 37.63 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -98.69 31.49 2.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.911 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -167.31 33.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.844 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.145 179.932 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.684 0.278 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.74 167.15 23.8 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.468 2.112 . . . . 0.0 112.211 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 57.9 30.01 18.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.762 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.488 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -104.5 135.38 19.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.046 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.69 125.89 18.4 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.412 2.074 . . . . 0.0 112.069 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.404 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -92.48 148.76 21.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.109 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.36 138.11 56.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.735 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -61.6 114.85 3.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.269 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.92 28.29 42.5 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.069 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.12 -178.92 5.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.883 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -106.73 -28.93 9.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.76 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -166.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.821 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.488 ' CD2' HG21 ' A' ' 60' ' ' ILE . 5.1 p80 -107.53 161.51 14.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.02 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 70' ' ' ILE . 6.9 mm -74.83 153.66 6.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.053 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -163.46 30.84 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -107.2 -178.99 3.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -84.46 -74.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -75.74 125.59 29.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 76' ' ' LEU . 46.6 mm -134.27 148.2 29.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.123 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.3 mp -105.38 106.97 17.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.465 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -90.93 114.98 27.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.784 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -148.94 163.47 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.115 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.739 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER 55.45 35.59 25.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.07 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 62.36 40.75 10.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -176.99 166.5 2.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.013 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -88.88 117.97 28.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.739 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 65.1 m95 -111.77 126.0 54.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.844 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.434 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -51.57 175.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.171 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -80.03 -40.69 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.283 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -91.08 -16.48 27.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.128 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -96.4 26.1 4.58 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.597 HD21 HG21 ' A' ' 28' ' ' ILE . 1.7 tp -128.62 29.24 5.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.996 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.38 150.26 21.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 4.3 t -60.46 125.25 22.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.816 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.29 -22.51 61.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.289 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -99.69 -63.08 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.735 0.302 . . . . 0.0 111.206 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.511 ' HB2' HG22 ' A' ' 95' ' ' VAL . 32.0 m -66.76 -32.31 73.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 59.07 23.35 11.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.102 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.511 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.1 m -90.82 149.34 40.17 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.153 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.82 118.95 5.8 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.561 2.174 . . . . 0.0 112.248 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.547 HD21 ' HB3' ' A' ' 110' ' ' CYS . 7.9 mp -111.04 63.05 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.78 39.49 1.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.188 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.754 ' C ' HD11 ' A' ' 28' ' ' ILE . 9.4 mt-10 -148.25 -49.18 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.587 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -136.52 174.2 10.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.628 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.8 t -156.98 156.15 32.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.504 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.7 OUTLIER -150.13 154.63 38.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 60.1 p -132.29 144.76 50.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.993 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.64 139.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.6 40.11 95.96 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.569 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 59.6 31.22 20.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -148.99 145.15 27.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.538 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.1 p -87.22 115.97 28.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.127 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.68 170.52 8.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.826 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.547 ' HB3' HD21 ' A' ' 97' ' ' LEU . 29.5 p -99.56 169.04 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.83 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 4.5 tttp -78.13 -29.79 49.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.267 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -53.42 -58.02 8.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.469 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.5 p30 -74.16 -20.94 60.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.314 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 13.5 t80 -63.65 -30.95 71.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.75 0.31 . . . . 0.0 110.926 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 5.1 m-85 -79.12 -39.21 34.21 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -85.07 -64.04 1.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.335 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -64.79 -48.62 73.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.64 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -102.01 36.89 1.98 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.332 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.94 -146.61 4.44 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.594 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.0 m -94.79 152.35 18.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 110.977 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.419 ' HZ3' ' HA ' ' A' ' 123' ' ' ALA . 0.0 OUTLIER -164.45 170.37 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.5 t -64.11 141.34 58.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.419 ' HA ' ' HZ3' ' A' ' 121' ' ' LYS . . . -94.74 27.14 3.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.121 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.24 -58.08 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.9 p -108.27 5.4 25.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.414 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 59.38 29.47 19.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.14 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.85 151.95 25.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.742 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -81.13 107.79 2.75 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.698 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.851 HG22 HD11 ' A' ' 15' ' ' LEU . 12.1 mt -70.41 130.92 88.7 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 110.52 -0.178 . . . . 0.0 110.52 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.643 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.5 Cg_exo -47.52 175.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.361 2.041 . . . . 0.0 112.23 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.7 Cg_endo -77.2 -49.91 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.471 2.114 . . . . 0.0 113.799 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.754 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -126.06 21.7 7.41 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.34 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.643 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -57.0 -168.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.68 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.777 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -123.59 108.9 21.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.936 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.697 ' HB ' HD11 ' A' ' 145' ' ' LEU . 12.4 p -152.67 158.87 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.065 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.481 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.86 135.92 38.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.793 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.93 135.0 47.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.975 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.619 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.31 96.57 2.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.939 0.399 . . . . 0.0 110.618 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.51 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.75 -86.33 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.4 -48.19 4.88 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.873 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -83.95 162.58 20.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.715 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.3 150.9 7.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.593 ' O ' HG21 ' A' ' 135' ' ' VAL . 23.0 m-85 -133.26 175.08 9.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.452 . . . . 0.0 111.37 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.31 161.84 22.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.046 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.777 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.6 mp -81.08 -30.2 34.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.149 0.5 . . . . 0.0 109.678 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -91.2 -49.26 6.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.665 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.7 m -53.87 -31.26 49.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.9 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.764 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.91 121.1 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.091 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.24 -177.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -100.92 150.14 23.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 152' ' ' VAL . 16.7 m -64.73 -26.87 41.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.263 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 151' ' ' VAL . 21.2 t -109.53 -55.9 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.338 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 m -65.86 -28.11 68.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.012 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 30.87 17.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.986 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -119.02 139.97 50.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.951 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.447 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.11 154.29 13.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.26 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.731 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.7 OUTLIER -116.57 107.32 14.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.538 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -90.17 172.28 8.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.681 HG23 ' HA2' ' A' ' 11' ' ' GLY . 7.9 m -43.01 132.29 4.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.734 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.35 -27.86 13.97 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.664 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.591 ' OD2' HD12 ' A' ' 157' ' ' LEU . 5.4 t0 -67.0 128.84 37.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.802 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.452 ' HA ' HG23 ' A' ' 9' ' ' VAL . 9.2 mt-10 -88.04 122.21 31.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.709 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -138.45 146.75 42.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.691 ' HB2' HG13 ' A' ' 172' ' ' VAL . 48.1 m-85 -101.58 151.47 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.619 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -107.65 110.96 22.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.797 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.5 mtp -69.4 161.23 29.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -62.7 -28.57 70.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.074 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -97.76 29.11 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.019 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.14 83.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.978 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.422 ' HE ' HG11 ' A' ' 151' ' ' VAL . 8.1 mtp180 -154.92 131.66 10.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.764 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 4.4 mp -83.62 128.21 34.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.691 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.4 p -145.11 122.45 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.082 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 20.4 m -58.38 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.412 ' HZ1' ' CD ' ' A' ' 162' ' ' GLU . 21.6 mttt -75.52 -57.05 4.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.84 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -33.6 70.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.108 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -72.98 -28.91 62.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -56.84 -66.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.946 0.403 . . . . 0.0 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.31 -49.73 75.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.942 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 67.5 m -59.43 -26.3 65.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.964 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -79.08 -51.98 8.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.252 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.74 -66.57 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.098 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.203 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.484 HG22 ' N ' ' A' ' 8' ' ' MET . 12.6 p . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.874 0.369 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.484 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.45 -173.64 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.595 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.3 p -151.82 147.69 15.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 161' ' ' ASP . 43.9 t -66.95 146.23 13.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.628 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.32 -157.9 9.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.572 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 0.0 OUTLIER -76.31 151.29 83.35 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.665 0.269 . . . . 0.0 110.815 -179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.777 ' HB2' HG12 ' A' ' 134' ' ' VAL . 2.6 Cg_endo -83.0 143.47 11.54 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.874 2.383 . . . . 0.0 112.417 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.57 142.92 8.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.344 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.559 HD21 ' CG1' ' A' ' 135' ' ' VAL . 7.7 mt -127.04 173.54 9.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 111.293 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.408 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -49.51 -50.49 41.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.793 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.583 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 62.69 80.82 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.457 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -160.27 -48.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.368 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 59.56 46.33 12.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 110.923 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE1' ' CD1' ' A' ' 115' ' ' PHE . 14.0 p90 -59.17 -179.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.929 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -173.54 -132.41 1.53 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.567 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.706 ' CB ' HD13 ' A' ' 27' ' ' LEU . 4.3 p-10 -55.21 -28.42 52.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.736 0.303 . . . . 0.0 111.16 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.35 -25.99 60.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.201 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.89 -70.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.073 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.3 tp10 -101.62 175.11 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 100.68 4.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 22' ' ' ASP . 2.9 tp -63.15 165.11 7.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.763 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.3 pt -62.9 148.49 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.5 m -107.74 106.78 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.82 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.19 101.82 9.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.435 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.86 154.02 40.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -78.63 157.05 28.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -110.6 102.31 10.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 41.3 p -60.18 86.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -150.32 -76.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 57.68 28.58 16.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.025 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -176.67 78.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.902 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 -179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.581 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.617 0.246 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 57' ' ' THR . 63.1 Cg_endo -73.43 163.96 36.34 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.49 2.127 . . . . 0.0 112.226 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 56.98 29.07 15.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.723 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -99.1 134.89 21.02 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.077 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.2 Cg_endo -58.46 125.96 19.95 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.458 2.105 . . . . 0.0 112.097 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.19 140.12 29.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.057 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.3 p -58.36 164.22 2.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.93 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.437 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.98 114.59 24.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.445 179.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 125.09 -66.46 0.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.56 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -109.83 155.34 21.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.858 0.361 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -75.39 87.53 2.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.143 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.47 134.44 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.723 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.5 p80 -72.77 141.05 48.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.6 mm -67.52 153.65 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -172.55 35.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.864 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.82 145.83 38.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.179 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.0 110.84 18.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.853 0.359 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 76' ' ' LEU . 42.0 mm -121.67 153.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.211 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 75' ' ' ILE . 7.8 mp -109.61 106.75 16.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.305 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -91.03 116.36 28.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.964 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.763 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -157.13 165.63 35.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.163 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.805 HD12 ' NE1' ' A' ' 83' ' ' TRP . 3.0 mt 59.09 36.43 24.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.072 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 62.3 34.42 15.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.023 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -176.45 178.57 1.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.917 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.406 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 22.1 p-80 -94.41 126.85 39.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.805 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.7 m95 -116.86 132.73 56.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.08 171.55 0.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.07 -40.21 28.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.089 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 pttp -90.95 -28.18 18.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.127 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 57.7 m -67.6 -30.62 70.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 83' ' ' TRP . 1.6 tp -81.12 94.12 6.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -155.35 154.53 32.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.933 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 147.03 38.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.7 t -72.78 -31.27 64.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.916 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -97.28 -59.97 1.68 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.977 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 45.7 m -60.02 -34.47 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 57.37 22.46 7.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.056 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -84.63 156.65 61.74 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.048 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.9 118.9 5.94 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.522 2.148 . . . . 0.0 112.246 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.583 HD23 ' SG ' ' A' ' 101' ' ' CYS . 7.4 mp -103.24 71.03 1.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -106.07 30.91 5.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -148.55 -49.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.617 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -142.99 128.99 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.583 ' SG ' HD23 ' A' ' 97' ' ' LEU . 1.5 t -123.83 171.09 9.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.6 m-85 -156.32 151.5 26.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.518 ' OG ' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -151.65 140.05 20.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -150.01 123.97 9.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.23 -88.64 1.59 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.506 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.02 35.86 0.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.447 ' HB2' ' CE1' ' A' ' 109' ' ' TYR . 48.9 m -150.73 -175.02 4.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 102' ' ' PHE . 11.7 p -136.97 116.0 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.082 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 107' ' ' SER . 1.3 m-85 -116.69 173.24 6.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.9 p -89.13 178.31 6.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 12.3 ttmt -73.65 -48.97 28.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.91 -30.55 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.218 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -84.04 -21.64 31.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.319 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 12.9 t80 -69.52 -41.17 76.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 6.6 m-85 -66.78 -36.8 83.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.921 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.36 -44.4 13.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.25 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -78.94 -50.92 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.244 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -108.67 37.02 2.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.59 165.25 33.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.444 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.795 HG22 HG11 ' A' ' 142' ' ' VAL . 1.6 m -57.85 151.08 18.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.757 0.313 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -163.3 159.43 22.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.167 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 124' ' ' ALA . 43.3 t -74.2 135.76 42.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.787 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.66 34.21 1.9 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 122' ' ' CYS . . . -125.12 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.096 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.5 p -109.9 12.54 23.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.411 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.7 mp0 55.5 30.84 15.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.754 0.311 . . . . 0.0 111.04 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -103.49 130.49 50.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.96 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.98 131.19 51.93 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.444 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.585 HG23 ' HD2' ' A' ' 130' ' ' PRO . 51.9 mt -79.25 140.06 56.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.922 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.589 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 92.7 Cg_exo -44.83 171.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.833 2.355 . . . . 0.0 112.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -77.37 -55.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.588 2.192 . . . . 0.0 114.807 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.583 HG23 ' CA ' ' A' ' 17' ' ' GLY . 1.6 m -126.55 21.46 7.13 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.589 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 82.9 mm-40 -61.42 -176.04 0.07 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.777 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.65 116.49 49.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.973 0.416 . . . . 0.0 111.167 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.559 ' CG1' HD21 ' A' ' 15' ' ' LEU . 8.8 p -157.06 162.96 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.538 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.22 142.17 28.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.016 0.436 . . . . 0.0 110.857 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.427 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.6 OUTLIER -116.05 123.64 48.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.836 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.517 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -57.43 96.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.077 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.98 -87.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.223 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 138' ' ' ALA . 6.5 t0 -96.64 -47.13 6.03 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.988 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.88 157.31 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.083 0.468 . . . . 0.0 111.746 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.795 HG11 HG22 ' A' ' 120' ' ' THR . 7.6 p -107.68 149.51 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.621 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -131.92 163.24 28.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.008 0.432 . . . . 0.0 111.403 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -63.59 165.38 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.964 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.64 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.2 mp -81.03 -32.76 33.99 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -91.34 -49.26 6.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.903 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.425 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 80.8 m -50.44 -38.93 46.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.795 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.5 t80 -56.91 118.38 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.233 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.09 179.24 2.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.048 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -85.33 150.09 25.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.971 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 152' ' ' VAL . 8.2 m -72.17 -34.64 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.144 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -102.95 -51.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 14.0 m -66.02 -28.05 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.982 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm 57.79 40.71 25.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.132 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -128.96 143.16 50.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.972 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.701 ' C ' HD22 ' A' ' 157' ' ' LEU . 13.9 mp0 -61.35 172.36 1.15 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.954 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 156' ' ' GLN . 1.8 mm? -127.45 164.62 21.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 158.91 43.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.4 t -43.01 129.46 4.44 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.619 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.75 -27.95 16.85 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.553 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.545 ' O ' HG23 ' A' ' 10' ' ' VAL . 30.1 m-20 -70.27 129.13 38.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.772 0.32 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -89.31 114.92 26.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.972 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.2 p90 -129.64 152.05 49.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 23.0 m-85 -101.48 139.31 37.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.739 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.517 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -99.94 127.09 46.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.707 179.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.4 mmt -90.66 161.92 15.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.039 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -23.6 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -96.05 27.45 3.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.093 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.06 30.09 15.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.099 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 154.52 19.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.862 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.795 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -109.25 121.73 45.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.024 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 172' ' ' VAL . 7.6 p -145.08 121.67 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.002 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 21.7 p -76.07 -169.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -43.39 54.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.283 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.05 -52.25 61.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.6 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -84.98 4.06 35.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.64 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.0 t80 -67.53 -66.11 0.6 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.881 0.372 . . . . 0.0 110.83 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.13 -23.53 65.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 75.2 m -84.64 -32.75 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.046 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -89.91 -29.66 18.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.284 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 61.79 175.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.965 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.617 HG23 ' CE1' ' A' ' 164' ' ' TYR . 12.5 p . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.789 0.328 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.66 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.11 178.73 6.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.663 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' A' ' 162' ' ' GLU . 9.4 p -154.96 135.39 4.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.248 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' CD1' ' A' ' 163' ' ' PHE . 61.4 t -53.54 146.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.592 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.585 ' C ' HG23 ' A' ' 159' ' ' THR . . . -139.35 -148.63 5.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.657 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 13' ' ' PRO . 25.3 mt-10 -72.98 115.28 38.74 Favored Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 122.906 -0.173 . . . . 0.0 110.73 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.558 ' O ' HG12 ' A' ' 134' ' ' VAL . 27.2 Cg_endo -62.3 135.41 53.91 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.251 1.967 . . . . 0.0 112.213 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.23 167.9 27.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.42 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 129' ' ' ILE . 1.4 mt -143.99 173.91 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.226 0.536 . . . . 0.0 111.746 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.427 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.96 -35.99 71.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.501 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.824 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.99 94.78 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.589 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.43 103.33 0.31 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.298 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 16.5 mt-10 -50.91 -71.71 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 111.069 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.404 ' HB2' ' CE1' ' A' ' 115' ' ' PHE . 29.0 t80 -176.94 -66.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.91 120.97 1.41 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.489 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.95 -44.22 14.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -29.69 68.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.79 -31.34 68.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.962 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 6.6 tp10 -109.23 160.68 15.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.933 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.29 101.92 5.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.901 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.643 HD11 ' HB3' ' A' ' 100' ' ' ARG . 0.7 OUTLIER -76.89 164.95 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.85 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.795 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.8 pt -62.95 147.88 11.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.22 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -114.88 106.91 14.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.757 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.77 101.83 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.626 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -145.65 146.86 31.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.947 -179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -75.4 147.75 39.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -104.87 160.14 15.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.6 t -98.7 32.56 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -105.63 78.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -94.23 -33.32 13.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.912 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -131.86 82.23 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.079 -179.971 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.665 0.269 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.12 164.57 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.542 2.161 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 59.5 30.81 20.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.925 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.716 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -103.81 134.75 19.56 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.034 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.455 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.3 Cg_endo -58.72 125.93 19.73 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.415 2.077 . . . . 0.0 112.056 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.33 138.51 31.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.13 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.8 p -57.98 164.27 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.86 114.66 24.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.501 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.59 -71.1 0.45 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.527 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 13.6 p -103.59 153.07 21.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.826 0.346 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -74.03 87.04 1.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -179.05 137.74 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.716 ' CD2' HG21 ' A' ' 60' ' ' ILE . 12.3 p80 -76.53 145.8 38.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -73.53 153.76 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.94 35.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.961 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.425 ' HB2' HD11 ' A' ' 75' ' ' ILE . 3.9 m-20 -110.59 159.61 17.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -60.11 -75.25 0.06 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -74.86 112.12 10.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.444 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.3 mm -120.93 152.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.226 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.9 mp -111.79 106.78 15.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -90.81 128.01 36.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.795 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -161.48 158.95 27.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.261 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.677 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.6 OUTLIER 59.57 38.45 22.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.09 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 61.43 29.32 18.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -173.9 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.866 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.409 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 23.4 p-80 -105.34 124.31 49.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.677 ' NE1' HD12 ' A' ' 79' ' ' LEU . 49.3 m95 -112.37 130.77 55.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.714 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.569 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.14 171.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.1 -39.98 28.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.003 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -91.03 -29.79 17.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 74.6 m -67.13 -30.73 70.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.957 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.464 ' CD2' HG21 ' A' ' 28' ' ' ILE . 1.6 tp -69.5 90.61 0.55 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -148.42 148.27 30.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.846 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.8 t -58.13 147.04 31.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 t -74.75 -29.1 61.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.252 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.847 0.356 . . . . 0.0 111.16 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.437 ' HB2' HG22 ' A' ' 95' ' ' VAL . 15.9 m -61.7 -32.57 72.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.053 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 54.15 24.73 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.129 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.437 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -83.9 146.7 49.67 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.138 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.63 118.99 5.69 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.533 2.155 . . . . 0.0 112.268 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -114.32 108.66 17.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.88 30.99 2.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.174 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.743 ' C ' HD11 ' A' ' 28' ' ' ILE . 12.0 mt-10 -139.78 -47.08 0.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.643 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -134.43 174.21 10.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.762 ' HB2' HG23 ' A' ' 28' ' ' ILE . 48.0 t -157.0 127.98 6.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.948 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 50.2 t80 -129.93 120.64 25.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.482 ' OG ' HD22 ' A' ' 79' ' ' LEU . 93.2 p -138.0 156.1 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.5 mtt85 -154.03 124.43 7.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.931 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.18 -54.15 4.22 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.532 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -176.33 -42.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.331 . . . . 0.0 110.88 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -78.73 151.29 32.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.832 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 108' ' ' VAL . 13.0 p -114.12 122.75 68.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.049 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.467 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -145.54 133.08 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 17.9 p -55.59 148.38 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 1.8 mtmp? -64.09 -19.98 65.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 t0 -46.62 -58.07 4.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.818 0.342 . . . . 0.0 111.323 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -77.68 -20.62 53.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.075 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.505 ' CZ ' ' CD2' ' A' ' 118' ' ' PHE . 11.1 t80 -58.16 -27.89 64.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.899 0.381 . . . . 0.0 110.695 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 1.9 m-85 -73.04 -28.77 62.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -82.31 -31.8 29.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.503 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.438 ' HD3' ' CE2' ' A' ' 118' ' ' PHE . 9.1 ptp180 -88.57 -37.25 15.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.443 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.505 ' CD2' ' CZ ' ' A' ' 114' ' ' PHE . 93.9 m-85 -103.36 -43.11 5.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.888 0.375 . . . . 0.0 111.151 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -70.31 170.83 44.37 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.468 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 71.5 m -58.65 152.36 18.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 110.805 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -138.65 172.33 13.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.037 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.499 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -85.27 129.61 34.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.51 30.62 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.034 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.848 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.08 -56.17 1.56 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.7 p -107.83 -20.12 13.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.162 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 68.63 70.74 0.29 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.84 0.353 . . . . 0.0 110.868 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 127' ' ' LEU . 3.9 tp -130.28 -165.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.842 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -105.48 99.35 1.56 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.678 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.705 HG23 HE21 ' A' ' 133' ' ' GLN . 16.1 mt -75.73 125.59 88.23 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.47 0.176 . . . . 0.0 110.719 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.613 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.8 Cg_exo -51.62 -180.0 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.141 1.894 . . . . 0.0 111.96 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 74.4 Cg_endo -77.32 -49.39 0.1 Allowed 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.398 2.065 . . . . 0.0 113.818 -179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.824 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.8 21.72 7.58 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.705 HE21 HG23 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -55.71 146.47 21.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.277 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.558 HG12 ' O ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -88.87 108.92 19.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.998 0.427 . . . . 0.0 111.028 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.516 HG12 ' HG ' ' A' ' 15' ' ' LEU . 12.0 p -153.25 159.33 3.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.105 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.493 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.77 137.64 35.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.666 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.477 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.1 OUTLIER -105.01 150.86 24.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.852 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -92.43 96.49 10.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.698 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 51.86 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.178 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.413 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -93.57 -46.88 7.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.843 -177.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 7.9 m-85 -87.27 166.92 14.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.679 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.477 HG23 ' CG ' ' A' ' 137' ' ' ARG . 7.3 p -119.82 127.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.785 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.848 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 4.3 m-85 -110.06 134.78 51.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.989 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 71.1 m80 -59.52 138.95 57.53 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.853 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.41 HD23 ' OE1' ' A' ' 133' ' ' GLN . 0.8 OUTLIER -60.43 -19.64 57.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -85.06 -37.88 19.8 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.9 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.7 p -98.16 12.88 33.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.852 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 3.4 t80 -86.14 121.92 29.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.735 0.302 . . . . 0.0 110.832 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.98 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.122 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 150.08 24.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 152' ' ' VAL . 4.7 m -66.08 -30.32 49.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.114 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 151' ' ' VAL . 27.9 t -111.81 -52.2 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.108 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 15.3 m -65.99 -28.05 68.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt 57.66 32.58 22.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.998 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -111.93 133.96 53.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.625 ' O ' HD13 ' A' ' 157' ' ' LEU . 6.0 mt-30 -62.3 157.91 18.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.124 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.735 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.3 OUTLIER -126.74 125.41 41.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -104.05 177.73 4.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.409 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.585 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.1 m -45.61 129.31 8.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.668 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.88 -27.09 15.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.792 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.58 128.97 39.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.76 0.314 . . . . 0.0 110.793 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.543 ' HA ' HG23 ' A' ' 9' ' ' VAL . 40.2 mt-10 -87.91 129.61 35.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.039 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.66 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 10.9 p90 -150.75 154.13 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.006 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.617 ' CE1' HG23 ' A' ' 7' ' ' VAL . 19.6 m-85 -106.46 171.02 7.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.852 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -128.47 111.03 12.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.827 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.91 -178.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.947 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -27.52 33.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -97.5 29.68 3.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.076 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.48 83.63 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.413 ' HB3' HG11 ' A' ' 151' ' ' VAL . 8.6 mtp180 -150.37 147.12 27.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.852 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.99 121.03 32.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.407 ' O ' HG13 ' A' ' 172' ' ' VAL . 9.4 p -145.09 126.39 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.949 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.1 p -78.07 -175.39 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.818 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -78.57 -26.94 45.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.13 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.94 78.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.35 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -103.92 -4.51 23.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.673 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -56.99 -66.19 0.49 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.75 -27.2 64.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.873 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 -39.75 61.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.12 4.05 51.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.599 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.04 -177.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.957 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.621 HG23 ' CE1' ' A' ' 164' ' ' TYR . 11.0 p . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.848 0.356 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.486 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -112.45 -176.94 3.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.643 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.462 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.1 p -155.14 136.53 5.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.345 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.3 t -61.38 145.54 12.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.649 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.14 -171.07 13.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.429 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.6 mt-10 -61.03 149.19 82.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.932 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.0 Cg_endo -78.27 138.79 16.21 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.593 2.195 . . . . 0.0 112.373 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -164.11 142.91 7.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.265 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -119.82 173.54 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.129 0.49 . . . . 0.0 111.455 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.469 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.44 -36.13 82.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.801 179.851 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.882 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.53 98.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.544 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.33 -76.95 0.12 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.568 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 61.05 77.37 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.785 0.326 . . . . 0.0 110.837 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.513 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 11.1 p90 -59.43 -39.51 83.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 65.17 179.77 8.05 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.638 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.555 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.9 p30 -57.63 -21.98 42.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.692 0.282 . . . . 0.0 111.195 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -54.45 -27.62 38.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -77.91 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.943 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 53.6 tp10 -92.75 156.28 17.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.991 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -76.02 100.05 4.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.839 HD21 ' HG2' ' A' ' 100' ' ' ARG . 2.4 tp -65.22 160.15 22.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 88' ' ' LEU . 1.6 pt -63.0 141.29 18.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.9 m -115.96 106.97 14.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.752 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -78.47 101.91 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.794 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.469 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -141.94 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.965 -179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -69.22 156.96 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -100.78 -170.07 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -98.83 -33.29 10.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.64 173.13 1.8 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.423 ' CE2' ' HD3' ' A' ' 73' ' ' ARG . 0.7 OUTLIER -176.24 -43.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -128.49 31.55 4.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.911 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.103 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.653 0.263 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.73 161.86 41.92 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.528 2.152 . . . . 0.0 112.191 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 59.73 31.18 20.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.721 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -104.72 134.73 19.51 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.046 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.8 Cg_endo -60.8 125.94 18.46 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.405 2.07 . . . . 0.0 112.102 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.71 140.44 32.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 p -57.59 164.2 2.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.0 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -85.12 114.67 22.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.569 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.13 -72.82 0.38 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.558 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.3 p -100.72 154.04 18.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.785 0.326 . . . . 0.0 110.962 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -76.03 86.22 2.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.158 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.04 127.63 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.721 ' CD2' HG21 ' A' ' 60' ' ' ILE . 10.1 p80 -63.97 161.84 15.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.933 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.574 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.8 mm -94.5 153.09 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.968 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.574 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -162.12 30.34 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.921 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -103.67 176.16 5.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.934 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.423 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -83.06 -78.32 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.708 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.26 97.37 0.93 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.755 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.633 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.9 141.34 20.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.633 ' H ' HD13 ' A' ' 75' ' ' ILE . 8.6 mp -89.81 106.98 18.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.621 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -90.9 115.53 28.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.752 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -157.02 158.93 37.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.261 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.789 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 59.33 36.77 23.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.077 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.18 30.22 17.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -168.22 178.77 4.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.452 ' HB2' HD12 ' A' ' 75' ' ' ILE . 27.3 p-80 -96.56 125.05 40.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.789 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.8 m95 -113.72 133.21 55.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.772 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.456 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.69 173.1 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -79.99 -40.65 27.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -90.97 -30.71 16.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -67.3 -31.03 71.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.983 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 28' ' ' ILE . 22.8 tp -71.7 81.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -138.55 164.11 30.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.14 146.89 43.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.925 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.17 -27.41 68.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.059 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -111.73 -57.77 2.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.038 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -59.25 -45.17 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.068 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 61.09 23.25 13.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.1 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.505 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 m -86.57 157.77 55.05 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.164 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.14 118.96 5.93 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.482 2.121 . . . . 0.0 112.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 95' ' ' VAL . 7.1 mp -110.05 35.95 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.659 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.54 -17.82 63.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.559 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.816 ' C ' HD11 ' A' ' 28' ' ' ILE . 14.6 mt-10 -91.35 -55.34 3.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.755 0.312 . . . . 0.0 110.987 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.839 ' HG2' HD21 ' A' ' 27' ' ' LEU . 1.4 mpt_? -142.6 160.97 39.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.849 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.577 ' HB3' HG23 ' A' ' 28' ' ' ILE . 52.8 t -157.06 127.95 6.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.532 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.5 OUTLIER -105.89 160.63 15.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -139.75 157.62 45.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 109' ' ' TYR . 2.8 mmp_? -141.31 172.06 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.818 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.78 68.48 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.566 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -90.08 -71.1 0.63 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.784 0.326 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.06 -173.23 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.972 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.5 p -99.5 123.33 52.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.16 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.421 ' CE2' ' HG3' ' A' ' 104' ' ' ARG . 1.1 m-85 -121.49 161.57 22.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 15.1 p -82.92 168.38 17.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.713 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 1.0 OUTLIER -57.9 -35.99 71.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.022 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.437 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 4.4 t70 -76.33 -23.6 54.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.194 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.6 -21.06 49.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.407 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.513 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 11.6 t80 -67.64 -44.89 76.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.813 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.497 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 17.3 m-85 -59.6 -42.89 93.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.871 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.71 -28.01 40.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.5 mmt-85 -78.08 -54.97 5.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.217 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -110.88 -43.06 3.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.168 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.15 168.88 3.89 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.636 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 84.8 m -65.3 153.26 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.741 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.24 162.1 37.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.555 ' CA ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -77.94 128.67 34.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.34 30.67 3.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.04 -49.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 30.9 p -116.57 -0.92 12.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.421 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 127' ' ' LEU . 2.2 mp0 62.6 69.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.922 0.391 . . . . 0.0 110.928 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 126' ' ' GLN . 1.1 mp -146.83 143.0 28.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.778 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.4 104.34 1.84 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.702 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.555 HD11 ' CA ' ' A' ' 122' ' ' CYS . 1.7 mp -72.07 138.23 82.0 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.507 0.194 . . . . 0.0 110.708 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 94.6 Cg_exo -43.08 171.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.746 2.297 . . . . 0.0 112.844 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.39 -55.2 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.835 2.357 . . . . 0.0 113.828 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.882 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.95 21.46 7.52 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.243 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.604 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.5 OUTLIER -63.43 139.11 58.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.484 179.768 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.932 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -73.44 108.76 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.039 0.447 . . . . 0.0 111.007 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.7 p -146.11 160.47 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.85 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.514 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.32 134.85 38.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.45 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -114.13 130.57 56.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.923 -179.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -66.59 96.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.72 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 46.76 -88.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.491 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 138' ' ' ALA . 19.4 p-10 -89.24 -43.89 10.66 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.879 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CD2' ' OD1' ' A' ' 140' ' ' ASP . 5.8 m-85 -89.32 164.14 15.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.989 0.423 . . . . 0.0 111.682 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.486 ' CG1' HD13 ' A' ' 129' ' ' ILE . 9.3 p -114.04 149.33 16.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.71 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -132.3 174.91 9.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.383 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.412 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 47.2 m80 -98.22 144.21 27.9 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.879 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.655 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -63.01 -17.92 62.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.389 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.25 -47.95 7.2 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.798 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -84.4 -31.61 24.6 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.855 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 31.7 t80 -56.84 110.19 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.351 . . . . 0.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -161.17 -176.97 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.074 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.5 150.03 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.019 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 171' ' ' LEU . 11.7 m -64.73 -29.42 47.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.749 HG23 HG23 ' A' ' 151' ' ' VAL . 21.1 t -110.9 -51.6 6.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.184 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 38.4 m -65.94 -28.09 68.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm 53.15 30.6 10.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -111.1 140.03 45.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.431 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.9 mp0 -61.78 156.17 21.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.901 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -117.88 168.11 10.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.844 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.1 168.85 19.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.022 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.6 t -47.96 126.69 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.26 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.47 -25.27 27.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.736 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.462 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.3 t70 -66.63 128.82 37.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.698 0.285 . . . . 0.0 110.656 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -91.38 119.07 31.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.19 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.643 ' CD2' HD23 ' A' ' 171' ' ' LEU . 3.4 p90 -138.71 164.6 29.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.837 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.621 ' CE1' HG23 ' A' ' 7' ' ' VAL . 76.8 m-85 -112.63 156.84 22.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.862 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.525 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -116.19 113.33 22.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.7 mmt -58.13 177.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -58.28 -49.02 78.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.993 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -74.3 -78.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 40.7 p -177.24 37.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.796 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -93.3 144.93 24.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.855 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -94.59 120.96 35.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.603 HG13 ' HB2' ' A' ' 164' ' ' TYR . 10.0 p -139.73 130.58 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.068 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.6 p -86.13 -172.4 4.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.428 ' NZ ' HG21 ' A' ' 7' ' ' VAL . 1.1 mptp? -63.75 -57.76 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.032 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.38 -29.44 48.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.297 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.472 ' CB ' HG23 ' A' ' 172' ' ' VAL . 58.1 m-20 -90.04 -23.46 21.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.467 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.3 t80 -56.12 -66.12 0.48 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.953 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.26 -44.91 94.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 65.9 m -61.26 -31.5 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -76.07 -51.35 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.69 -67.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . 0.421 ' HB3' ' CE2' ' A' ' 177' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.875 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.491 HG22 ' N ' ' A' ' 8' ' ' MET . 12.1 p . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.873 0.368 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.558 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.62 -176.94 6.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.558 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -150.77 150.61 13.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.352 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.737 HG21 ' HB3' ' A' ' 157' ' ' LEU . 24.3 t -66.92 146.42 13.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.831 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.7 -179.65 16.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.385 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -57.4 139.39 80.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.475 0.179 . . . . 0.0 110.678 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.651 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.84 140.49 61.38 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.364 2.043 . . . . 0.0 112.493 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -166.14 142.94 5.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.257 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.801 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -114.89 173.26 6.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.079 0.466 . . . . 0.0 111.333 -179.553 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.635 ' HE3' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -62.77 -34.35 77.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.788 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.851 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.18 65.23 3.66 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.417 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -153.6 82.22 0.17 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.622 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -84.2 5.05 27.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.547 0.213 . . . . 0.0 111.225 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 2.9 m-85 69.89 -67.04 0.25 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.36 133.88 3.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.597 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.02 -30.39 26.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.904 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.88 -31.15 71.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.52 -75.09 0.05 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG2' ' CD1' ' A' ' 102' ' ' PHE . 9.1 tp10 -60.06 165.37 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.878 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -75.91 99.95 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.719 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 100' ' ' ARG . 3.1 tp -86.0 165.0 17.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.012 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.854 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.96 149.92 9.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.9 m -122.59 106.88 11.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.796 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -80.62 101.76 9.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.505 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.17 166.04 27.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.036 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -81.26 157.04 25.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.96 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -102.78 174.47 5.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 p -103.0 35.92 2.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -128.4 161.73 28.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -166.25 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -150.61 80.22 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.12 179.989 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.757 0.313 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.03 168.98 19.03 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.527 2.151 . . . . 0.0 112.156 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 57.85 29.88 18.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.866 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.437 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.1 tp -98.69 135.18 21.12 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.056 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.3 Cg_endo -60.35 125.87 18.58 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.35 2.034 . . . . 0.0 111.964 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -102.71 151.14 22.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.153 -179.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.451 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 4.5 t -58.16 137.73 56.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.787 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -62.5 114.65 3.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.172 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.05 25.68 39.81 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.11 -178.9 4.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.931 0.396 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -112.76 -30.74 6.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.182 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.95 -168.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.063 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 62' ' ' MET . 2.1 p80 -102.36 172.42 6.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.655 ' C ' HD23 ' A' ' 71' ' ' LEU . 12.8 mm -98.06 154.13 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.297 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.655 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -167.02 32.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.68 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -99.17 -179.06 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.894 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.25 -67.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.55 133.65 33.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.067 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.435 ' C ' HD12 ' A' ' 76' ' ' LEU . 41.9 mm -138.89 151.42 23.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.111 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 76' ' ' LEU . 6.2 mp -105.05 106.95 17.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.528 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -90.96 115.02 27.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -147.75 159.4 43.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.071 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.527 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.33 36.1 24.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.076 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.47 39.59 11.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -174.03 162.89 3.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.451 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 43.1 p-80 -86.79 117.88 25.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.959 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.527 ' NE1' HD12 ' A' ' 79' ' ' LEU . 86.0 m95 -108.09 124.6 50.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.74 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.09 174.45 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.964 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -80.06 -38.37 32.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.353 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -91.19 -22.17 20.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.958 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.7 m -95.53 26.76 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.854 HD21 HG21 ' A' ' 28' ' ' ILE . 56.0 tp -129.89 88.68 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.835 0.35 . . . . 0.0 111.023 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 161.54 37.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -59.02 147.0 36.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -75.6 -31.07 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -95.8 -60.6 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -60.25 -34.83 74.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.873 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 58.19 31.15 20.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.014 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.467 ' O ' HD13 ' A' ' 97' ' ' LEU . 17.0 t -97.86 133.01 23.8 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.1 118.97 3.1 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.542 2.162 . . . . 0.0 112.557 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 95' ' ' VAL . 5.6 mp -101.86 77.47 1.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.825 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -108.92 38.15 2.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -152.68 -66.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.611 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -127.04 133.86 50.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.736 ' SG ' HD11 ' A' ' 88' ' ' LEU . 1.9 t -123.36 128.04 49.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.907 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.418 ' CD1' ' HG2' ' A' ' 25' ' ' GLU . 0.4 OUTLIER -112.35 153.64 26.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.2 t -127.43 117.82 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.881 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -149.71 123.96 9.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.47 50.22 45.39 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.482 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 68.91 -67.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 m -58.43 151.2 20.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.952 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.06 134.76 27.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.047 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -122.94 156.38 34.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.937 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.4 p -112.78 135.94 52.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.692 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.447 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -51.97 -35.57 46.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.188 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -45.14 -48.89 12.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.45 -20.8 33.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.85 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.46 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 11.1 t80 -64.13 -34.96 79.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.447 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 40.6 m-85 -65.11 -40.94 95.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.93 0.395 . . . . 0.0 110.756 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -74.8 -56.52 4.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.311 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -73.49 -51.92 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.468 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 96.6 m-85 -98.53 37.01 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.203 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.99 -143.71 3.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.635 ' HB ' ' HE3' ' A' ' 16' ' ' MET . 80.7 m -103.07 155.0 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.711 0.291 . . . . 0.0 110.814 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -151.62 158.42 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.875 0.369 . . . . 0.0 111.191 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.468 ' HA ' HD11 ' A' ' 129' ' ' ILE . 52.1 t -74.28 136.78 42.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.722 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.46 30.23 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.23 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -58.15 1.47 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 18.0 p -110.37 18.2 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.211 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 54.41 28.37 9.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.778 0.323 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.426 HD23 ' CE1' ' A' ' 144' ' ' HIS . 14.4 tp -100.86 134.71 43.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.829 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.0 110.87 3.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.625 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.786 HG22 HD11 ' A' ' 15' ' ' LEU . 11.4 mt -63.7 139.56 97.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.555 0.216 . . . . 0.0 110.895 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.573 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 91.9 Cg_exo -44.59 172.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.672 2.248 . . . . 0.0 112.598 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.09 -55.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.908 2.405 . . . . 0.0 114.464 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.851 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.32 21.39 7.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.573 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 67.0 mm-40 -61.22 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.471 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.768 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -118.81 112.16 36.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.946 0.403 . . . . 0.0 111.079 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.801 HG12 ' HG ' ' A' ' 15' ' ' LEU . 8.7 p -157.05 161.39 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.733 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.531 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.25 134.92 38.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.639 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.837 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -113.91 136.57 52.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.811 -179.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -72.68 96.32 1.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.861 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 38.1 -89.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.2 m-20 -79.05 -38.5 36.3 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.205 -177.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.41 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.7 m-85 -105.84 168.19 9.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.837 HG22 ' CB ' ' A' ' 137' ' ' ARG . 46.9 t -122.58 148.12 26.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.514 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.572 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.9 m-85 -133.56 170.18 15.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.118 0.485 . . . . 0.0 111.733 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 0.1 OUTLIER -65.83 168.78 7.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.907 179.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.768 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.5 mp -81.04 -29.96 34.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 177.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -91.42 -49.3 6.41 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.11 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 79.7 m -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.245 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.675 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.6 t80 -56.84 114.58 2.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.021 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.1 -177.02 1.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 153' ' ' CYS . 30.6 t -97.68 150.07 21.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 152' ' ' VAL . 21.3 m -66.81 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -106.22 -55.88 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.345 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 150' ' ' CYS . 25.8 m -65.84 -28.19 68.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.005 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? 54.73 31.65 15.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.69 146.83 46.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.855 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.6 mp0 -62.19 154.13 28.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.737 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.7 mm? -112.16 123.27 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -98.88 157.67 16.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.0 t -44.69 133.51 5.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.26 -32.98 6.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.628 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.519 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -67.15 131.06 45.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 0.0 110.812 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.04 113.89 24.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.031 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.784 ' CD2' HD23 ' A' ' 171' ' ' LEU . 9.0 p90 -126.49 153.27 45.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.927 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m-85 -102.16 163.27 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.743 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.6 tp -120.7 112.11 18.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.801 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.14 167.85 2.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.36 -29.65 67.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.5 -79.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.038 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.43 38.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.823 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -105.54 117.58 34.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.784 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -69.4 127.22 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.07 126.66 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.056 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.1 m -58.77 -170.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.811 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -73.42 -55.86 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.71 -43.91 97.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.101 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -59.37 -25.76 64.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.056 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -55.83 -66.09 0.48 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.999 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -56.44 -28.14 58.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.118 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -30.5 43.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.985 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -90.45 -29.18 18.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.246 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm 61.88 174.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.847 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.853 -179.917 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.491 HG22 ' N ' ' A' ' 8' ' ' MET . 10.9 p . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.845 0.355 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -139.51 -177.4 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.639 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.443 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.9 p -155.06 135.7 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.227 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' A' ' 163' ' ' PHE . 57.5 t -58.9 146.17 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.01 -153.18 8.7 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.664 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 60.0 mt-10 -67.66 141.51 95.19 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.534 0.207 . . . . 0.0 110.748 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.604 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.0 Cg_endo -83.03 129.91 5.48 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.716 2.277 . . . . 0.0 112.396 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -156.43 155.17 31.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.349 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.558 HD21 ' CG1' ' A' ' 135' ' ' VAL . 8.2 mt -136.28 173.38 11.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.874 0.369 . . . . 0.0 111.091 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.409 ' HE3' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.66 -50.66 32.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.777 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.857 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 63.13 88.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.583 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.98 -41.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.424 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 58.4 23.27 10.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.75 0.31 . . . . 0.0 111.026 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 56.95 -172.91 0.08 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.872 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.18 136.76 7.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.89 -31.23 61.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.748 0.308 . . . . 0.0 110.854 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.15 -27.9 61.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.038 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -56.31 -31.18 63.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.025 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.7 OUTLIER -113.01 174.19 6.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -75.98 121.61 22.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.834 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 100' ' ' ARG . 3.1 tp -105.13 163.68 12.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.839 HG23 ' HB2' ' A' ' 101' ' ' CYS . 8.3 pt -63.04 146.31 12.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.139 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.402 HG22 ' HG ' ' A' ' 31' ' ' LEU . 50.3 m -113.46 106.84 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.833 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -77.08 101.75 6.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.491 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.03 155.9 42.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.968 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -77.72 152.35 33.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -99.24 -27.52 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 34' ' ' THR . 8.8 m 63.37 37.56 10.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.817 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -124.44 73.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.836 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE2' ' NH1' ' A' ' 73' ' ' ARG . 2.2 t80 -70.55 -44.4 67.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -102.06 141.32 35.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.068 179.957 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.108 0 CA-C-O 120.638 0.256 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.47 165.53 1.02 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.558 2.172 . . . . 0.0 112.265 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 59.71 31.16 20.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.447 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -106.29 134.93 19.56 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.053 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.6 Cg_endo -60.14 125.9 18.79 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.405 2.07 . . . . 0.0 112.031 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.5 mtt -99.19 135.94 39.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.43 ' HB2' ' CG1' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -58.03 147.54 29.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.654 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.486 ' HB1' ' CE3' ' A' ' 83' ' ' TRP . . . -62.12 114.82 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.068 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 97.37 -22.24 41.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.967 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.76 -178.82 6.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -144.4 46.88 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.01 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -150.68 -83.35 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.014 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 176.03 -177.55 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.933 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.688 ' C ' HD23 ' A' ' 71' ' ' LEU . 7.7 mm -126.93 153.72 36.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.688 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -172.79 35.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.886 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HB2' HD11 ' A' ' 75' ' ' ILE . 23.8 m-20 -100.3 -179.54 4.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' NH1' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -81.73 -79.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.548 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.4 OUTLIER -77.92 132.75 38.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.548 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.5 mm -136.03 152.48 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.115 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.0 mp -106.97 106.91 17.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.437 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -90.84 120.83 32.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.677 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.87 154.75 34.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.114 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.883 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.74 37.72 28.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.21 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.72 40.68 12.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.911 0.386 . . . . 0.0 111.145 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -176.64 159.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.822 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.44 ' CD2' HG13 ' A' ' 70' ' ' ILE . 29.9 p-80 -85.17 117.93 24.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.883 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 77.9 m95 -106.93 122.92 47.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.608 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.482 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.98 151.84 11.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.894 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -59.01 -35.89 74.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.843 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mttt -91.15 -48.9 6.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.94 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 21.0 m -58.48 -27.95 64.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.117 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.667 HD21 HG21 ' A' ' 28' ' ' ILE . 54.6 tp -72.17 88.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 96' ' ' PRO . 24.3 mmtt -134.96 159.29 41.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 53.3 t -60.75 147.03 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.79 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -62.59 -39.91 95.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.506 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -99.7 -63.12 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.434 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.2 m -56.36 -33.23 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.314 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 53.68 24.98 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.026 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -86.03 161.51 49.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.261 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HA ' ' HD3' ' A' ' 89' ' ' LYS . 51.2 Cg_exo -54.18 118.96 5.58 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.594 2.196 . . . . 0.0 112.309 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 mp -126.83 74.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.809 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -116.64 30.98 7.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -137.43 -55.04 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.451 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.71 135.07 47.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.933 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.839 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.6 t -113.02 163.87 14.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.834 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.9 t80 -165.32 120.95 1.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 90.1 p -151.98 172.35 16.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -167.43 123.99 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.5 -87.1 1.31 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.471 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -150.77 36.25 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.883 0.373 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.7 m -156.23 142.5 18.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.1 p -112.6 115.98 51.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.461 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -130.08 121.03 25.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.84 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.0 p -49.63 173.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.224 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 11.7 mtpt -78.16 -28.79 48.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.452 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.4 t70 -52.91 -52.91 56.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.264 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -84.05 -20.7 32.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.277 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.484 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 14.4 t80 -61.48 -33.3 73.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.0 110.758 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.6 m-85 -59.71 -45.34 92.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.77 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -74.68 -27.02 60.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.005 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -64.2 -54.99 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.223 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -117.03 -42.99 2.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -56.93 171.89 2.46 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -58.93 149.22 27.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.789 0.328 . . . . 0.0 110.931 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -150.88 162.13 41.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 16.1 t -79.0 155.8 28.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.953 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -111.09 -20.56 12.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.363 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.485 ' HB2' ' CD2' ' A' ' 143' ' ' TYR . . . -78.22 -58.03 3.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.05 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.26 -12.08 21.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.186 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 36.75 12.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.5 tp -109.49 144.17 38.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.44 104.25 0.74 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.553 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 142' ' ' VAL . 64.8 mt -61.42 140.38 94.75 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.638 0.256 . . . . 0.0 110.987 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.568 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 83.8 Cg_exo -43.97 170.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.874 2.383 . . . . 0.0 112.814 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.35 -55.58 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.479 2.12 . . . . 0.0 114.831 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.857 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.63 21.48 7.07 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 84.2 mm-40 -59.57 -178.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.791 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.604 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -122.52 114.35 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.071 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.564 HG22 ' N ' ' A' ' 136' ' ' ARG . 11.4 p -157.05 164.56 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.564 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -95.8 137.68 34.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.346 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.519 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.61 133.52 49.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.018 -179.267 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.632 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -67.96 96.31 0.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.761 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.97 -89.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.4 t70 -80.64 -39.53 27.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.377 -177.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 138' ' ' ALA . 2.9 m-85 -106.65 173.35 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.852 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.9 p -126.65 149.0 31.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.604 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.632 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.6 m-85 -131.88 158.88 40.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 111.364 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 76.7 m80 -71.53 137.92 48.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.042 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.54 -17.79 60.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.33 -37.37 21.7 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.393 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 7.7 p -96.43 -19.05 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.73 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 4.8 t80 -60.1 119.53 8.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.708 0.29 . . . . 0.0 110.804 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.02 -176.87 1.77 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.207 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.67 150.06 25.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 5.4 m -68.98 -30.16 45.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.143 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -109.48 -52.61 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.173 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 13.8 m -66.04 -28.1 68.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.005 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 58.01 34.58 24.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.995 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -115.47 137.33 52.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.449 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.7 mt-30 -64.63 155.25 33.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.025 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.1 mm? -115.44 164.25 14.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.682 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.08 169.34 18.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.418 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 m -42.79 122.19 2.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.71 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.24 -22.87 36.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.724 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.443 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.9 t70 -64.35 128.88 37.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 110.774 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 53.6 mt-10 -91.31 115.35 27.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -137.44 169.26 18.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.021 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.531 ' HB2' HG13 ' A' ' 172' ' ' VAL . 87.2 m-85 -115.51 171.01 7.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.628 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.9 OUTLIER -124.93 116.45 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.821 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mtp -72.26 -176.24 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.976 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.01 -26.22 31.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.18 30.33 2.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.049 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 12.9 p 58.32 45.35 17.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.025 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.06 155.3 19.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -105.06 123.47 47.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.531 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.9 p -142.54 125.26 13.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.06 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 23.3 p -78.53 -171.0 2.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.951 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -79.1 -30.18 43.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.149 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.55 -34.94 79.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.389 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -104.14 4.11 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.594 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 8.8 t80 -65.93 -66.12 0.59 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 110.778 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -59.12 -26.06 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.032 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.5 m -72.98 -27.69 61.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.093 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.35 -32.12 12.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.914 0.387 . . . . 0.0 110.738 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . 0.446 ' HE3' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER 179.29 171.54 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.929 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.876 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.442 HG22 ' N ' ' A' ' 8' ' ' MET . 12.8 p . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.881 0.372 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.576 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -154.98 -173.12 4.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.627 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.412 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.0 p -155.06 144.8 13.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.223 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 32.6 t -67.79 146.2 13.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.688 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -129.92 -176.18 14.33 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.629 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 3.6 mm-40 -59.85 148.2 76.95 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 120.573 0.225 . . . . 0.0 110.775 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.837 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.6 Cg_exo -77.92 137.02 15.38 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.642 2.228 . . . . 0.0 112.586 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.01 142.85 5.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.985 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.807 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -120.53 173.6 7.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.202 0.525 . . . . 0.0 111.445 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.567 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -71.17 -28.84 64.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.017 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.957 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.72 56.28 26.16 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.304 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.52 -50.17 70.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.6 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 70.08 -64.81 0.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.48 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER 62.85 163.14 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.907 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.46 -170.94 44.1 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.577 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -59.19 -28.47 66.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 0.0 111.078 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -56.64 -29.47 62.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.52 -75.28 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' CG ' ' CE2' ' A' ' 102' ' ' PHE . 52.4 mm-40 -113.57 172.83 6.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.845 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ptp85 -76.04 144.49 40.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.673 HD21 ' HG2' ' A' ' 100' ' ' ARG . 1.5 tp -111.99 163.68 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.819 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 4.6 pt -62.93 161.83 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.176 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -130.81 106.85 8.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.3 101.8 7.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.534 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -142.62 150.36 40.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.431 ' HG3' ' CD1' ' A' ' 74' ' ' PHE . 2.8 mt-10 -68.48 157.06 36.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HG22 ' A' ' 34' ' ' THR . 2.4 m120 -123.7 19.5 9.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.226 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 33' ' ' ASN . 13.6 t 43.95 31.21 0.48 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.382 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -120.24 162.3 19.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -177.14 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -114.04 107.3 15.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.956 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.576 ' HB3' HD22 ' A' ' 71' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.076 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.727 0.299 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.38 161.35 46.23 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.497 2.132 . . . . 0.0 112.246 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 60.2 33.84 21.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.714 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -108.94 134.63 20.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.453 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.8 Cg_endo -60.17 125.99 19.0 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.435 2.09 . . . . 0.0 112.119 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.38 140.51 30.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.107 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.0 p -58.07 164.2 2.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.975 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.456 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.46 114.59 23.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.515 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.83 -69.81 0.46 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.6 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.1 p -105.25 153.77 21.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -74.52 87.13 2.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.21 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -179.22 133.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.714 ' CD2' HG21 ' A' ' 60' ' ' ILE . 12.6 p80 -72.1 143.62 48.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 84' ' ' HIS . 4.9 mm -70.76 152.08 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.576 HD22 ' HB3' ' A' ' 38' ' ' ALA . 0.7 OUTLIER -174.21 35.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.91 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -107.53 162.84 13.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.925 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -59.64 -74.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.431 ' CD1' ' HG3' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -82.91 120.87 26.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.021 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.32 146.68 28.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.205 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.7 106.67 17.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.435 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -91.48 127.61 36.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -166.68 165.24 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.188 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.804 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.2 mt 59.25 37.25 23.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.109 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.83 29.52 17.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.014 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -169.89 -179.15 3.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.403 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 25.9 p-80 -97.2 124.63 41.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.87 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.804 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.4 m95 -115.77 130.58 56.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.718 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.564 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.99 170.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.909 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 p -80.02 -40.07 28.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.0 mttm -90.57 -26.85 19.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 68.4 m -71.06 -30.27 66.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.971 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.65 HD11 ' SG ' ' A' ' 101' ' ' CYS . 18.4 tp -76.6 80.3 3.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.852 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -135.94 153.18 51.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.71 135.48 48.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.766 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -29.21 68.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.063 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.24 -62.92 1.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.146 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.422 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.9 m -58.28 -34.98 71.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 55.33 23.72 5.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.112 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.5 m -85.97 156.37 57.9 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.216 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.55 118.95 5.92 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.497 2.131 . . . . 0.0 112.308 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.506 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.0 mp -104.02 65.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -98.05 30.25 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.111 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.797 ' C ' HD11 ' A' ' 28' ' ' ILE . 2.1 mm-40 -140.26 -51.94 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.673 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -132.25 174.36 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.74 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.2 t -157.01 141.6 16.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.449 ' CE2' ' CG ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -133.98 172.04 13.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -147.61 155.26 41.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -170.28 124.04 0.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.23 -90.62 0.36 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.444 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -153.87 36.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 m -153.21 153.08 32.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.3 p -85.71 116.02 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.04 160.19 20.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -97.98 171.22 8.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.743 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 102' ' ' PHE . 1.5 mttt -78.16 -32.9 50.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.477 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.5 -58.08 7.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.543 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -72.92 -20.83 61.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 4.4 t80 -64.38 -33.55 76.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 110.953 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 4.9 m-85 -79.15 -35.24 42.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.01 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -84.96 -59.05 2.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.284 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -71.54 -47.36 55.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.387 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -98.07 37.03 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.361 . . . . 0.0 111.064 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -149.06 -178.95 24.54 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.36 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.567 HG21 ' SD ' ' A' ' 16' ' ' MET . 72.4 m -60.11 153.53 21.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.794 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -144.44 174.27 11.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.126 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.734 ' HB2' HD11 ' A' ' 129' ' ' ILE . 41.8 t -93.4 130.76 39.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.799 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.456 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.81 29.53 3.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.111 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.687 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . . . -125.12 -53.27 1.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.26 -8.34 14.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.323 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 64.07 64.73 0.73 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.934 0.397 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 127' ' ' LEU . 5.2 tp -134.63 175.77 9.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -99.15 99.15 2.08 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.718 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.734 HD11 ' HB2' ' A' ' 122' ' ' CYS . 1.7 mp -74.45 138.14 74.6 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.424 0.154 . . . . 0.0 110.692 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.631 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 89.6 Cg_exo -44.4 173.2 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.596 2.197 . . . . 0.0 112.59 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.69 -55.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.861 2.374 . . . . 0.0 113.814 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.957 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -120.23 21.72 11.63 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.226 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.631 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.6 OUTLIER -67.95 137.55 55.25 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.584 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.837 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -74.14 108.77 5.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.807 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.3 p -143.08 158.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.773 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.41 134.81 39.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.893 0.378 . . . . 0.0 110.777 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -104.96 112.92 26.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.893 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.453 ' HB1' ' OE1' ' A' ' 139' ' ' GLN . . . -79.82 146.92 32.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.795 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.453 ' OE1' ' HB1' ' A' ' 138' ' ' ALA . 18.0 pm0 42.64 -142.28 0.11 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.334 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -89.74 35.26 0.83 Allowed 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.456 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 33.0 m-85 -151.41 169.0 23.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.914 0.388 . . . . 0.0 111.039 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.7 p -103.57 148.65 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.047 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.687 ' CZ ' ' HB2' ' A' ' 124' ' ' ALA . 6.9 m-85 -126.89 175.06 8.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.967 0.413 . . . . 0.0 111.21 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.458 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.8 m80 -104.95 136.85 43.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.648 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -55.75 -22.4 23.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 177.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.33 -36.0 14.1 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.674 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -97.14 1.65 50.18 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.458 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.5 t80 -86.03 115.84 23.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.777 0.323 . . . . 0.0 110.645 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.0 -176.95 1.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.259 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.54 150.21 20.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.025 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 152' ' ' VAL . 14.2 m -67.44 -27.29 38.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.289 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 151' ' ' VAL . 28.3 t -104.11 -55.7 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.424 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 30.1 m -65.94 -28.04 68.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.981 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm 57.53 28.5 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.999 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 34.2 mtm180 -121.74 147.75 45.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.425 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.7 mt-30 -66.76 153.43 43.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.038 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.1 mm? -115.89 139.93 49.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.728 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -107.37 167.0 10.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.163 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 t -46.79 138.55 6.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.33 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.33 -32.59 6.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.499 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.412 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.5 m-20 -63.81 128.92 37.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.766 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.404 ' HA ' HG23 ' A' ' 9' ' ' VAL . 11.7 mt-10 -93.7 116.18 28.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.994 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.65 ' CD2' HD23 ' A' ' 171' ' ' LEU . 13.8 p90 -126.91 166.28 17.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.917 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 23.4 m-85 -117.27 171.17 8.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.144 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 168' ' ' ASP . 1.2 tp -124.38 111.02 15.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.429 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 2.8 mmt -60.94 -89.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.264 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -83.23 -49.16 9.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.802 0.334 . . . . 0.0 111.097 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . 0.496 ' O ' HD21 ' A' ' 165' ' ' LEU . 2.3 t0 176.82 -38.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.748 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 33.7 p -115.4 30.76 7.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.9 mtt180 -120.48 132.21 55.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.65 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -103.84 123.69 47.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.837 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.512 ' O ' HG13 ' A' ' 172' ' ' VAL . 13.4 p -145.07 118.92 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.094 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.3 m -55.37 -176.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.015 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -69.31 -49.0 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.17 84.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -59.45 -25.95 64.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.937 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -54.54 -65.31 0.6 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.018 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -54.13 -23.49 14.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.304 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.0 m -87.07 -26.77 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -52.07 4.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.487 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 171.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.927 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 -179.959 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 11.0 p . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.845 0.355 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -146.1 -179.3 6.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.679 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.4 p -155.02 135.38 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.29 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' CD1' ' A' ' 163' ' ' PHE . 41.3 t -59.03 146.27 9.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.489 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -136.12 -159.75 8.57 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.743 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.33 123.27 69.35 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.514 0.197 . . . . 0.0 110.901 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.566 ' HB2' HG12 ' A' ' 134' ' ' VAL . 23.1 Cg_exo -62.03 138.42 72.96 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.309 2.006 . . . . 0.0 112.263 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -166.03 148.56 7.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.781 HD11 HG22 ' A' ' 129' ' ' ILE . 1.1 mt -116.84 173.4 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.294 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.437 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.58 -37.09 77.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.866 179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.9 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.44 81.54 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.543 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.84 -72.29 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 60.67 86.87 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.782 0.325 . . . . 0.0 110.826 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.524 ' CZ ' ' CE1' ' A' ' 115' ' ' PHE . 29.7 p90 -59.79 -44.47 93.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.036 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.436 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 57.39 -120.91 23.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.563 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -83.94 -23.86 30.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.733 0.301 . . . . 0.0 111.168 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.99 -29.98 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.175 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.19 -73.55 0.39 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.874 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 19.9 tp10 -120.99 163.49 18.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 147.87 38.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.3 mm? -101.58 165.13 11.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.972 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.875 HG21 HD21 ' A' ' 88' ' ' LEU . 4.1 pt -62.97 144.01 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.147 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.6 m -110.29 106.85 16.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 101.83 10.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.552 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.512 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.35 157.16 44.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.996 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -87.04 157.05 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -110.83 -178.09 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 p -120.64 37.22 4.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -90.42 -54.03 4.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.0 t80 68.5 -68.1 0.18 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.9 -65.26 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.211 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.767 0.318 . . . . 0.0 110.888 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -51.72 164.7 0.91 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.554 2.169 . . . . 0.0 112.293 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 59.31 31.2 20.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.563 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -109.79 135.0 20.46 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.445 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.56 125.95 18.66 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.379 2.053 . . . . 0.0 112.144 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.54 139.34 30.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.9 p -57.73 164.22 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.3 114.67 23.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.44 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.45 -75.04 0.38 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.607 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.2 p -98.78 152.33 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 110.941 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 87.25 1.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.02 136.85 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.563 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.5 p80 -73.76 151.48 40.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.972 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.541 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -79.69 153.51 4.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.908 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.403 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.6 OUTLIER -173.41 35.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -109.3 163.05 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -77.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.42 120.57 22.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.9 mm -122.83 154.02 27.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.6 mp -112.2 106.83 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.369 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -90.85 129.39 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.967 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -161.41 162.78 30.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.182 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.658 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 55.01 36.13 26.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.14 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 62.5 30.19 17.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.012 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -164.03 170.11 17.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.411 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 30.8 p-80 -88.38 120.94 30.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.682 ' CB ' HD13 ' A' ' 88' ' ' LEU . 47.4 m95 -110.17 130.04 55.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.541 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.54 174.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.7 t -79.99 -42.17 24.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -90.35 -29.75 17.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.956 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.6 m -69.63 -31.41 69.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.875 HD21 HG21 ' A' ' 28' ' ' ILE . 7.3 tp -72.82 77.52 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -137.05 165.46 25.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.809 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.59 147.07 39.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -28.49 67.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.013 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -111.49 -57.24 2.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 26.9 m -57.76 -46.1 85.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.067 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 94' ' ' HIS . 10.5 t-160 58.31 21.7 8.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.538 ' O ' HD13 ' A' ' 97' ' ' LEU . 13.3 m -86.47 155.69 56.74 Favored Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.118 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 118.98 5.95 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.495 2.13 . . . . 0.0 112.081 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 88' ' ' LEU . 7.4 mp -107.59 64.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.805 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -100.04 30.66 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.112 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.78 ' N ' HD11 ' A' ' 28' ' ' ILE . 15.3 mm-40 -138.48 -47.23 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.676 ' CB ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -153.58 148.12 26.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.816 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.634 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.5 t -143.2 128.24 18.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.438 ' CD1' ' HG3' ' A' ' 111' ' ' LYS . 0.6 OUTLIER -111.52 172.03 7.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.807 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 p -152.24 122.72 7.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.946 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.13 124.06 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.13 -102.02 2.01 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.495 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -143.56 34.92 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -153.33 152.46 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.436 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.9 p -77.98 124.47 36.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -121.01 143.31 49.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.002 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.0 p -87.91 153.54 21.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.438 ' HG3' ' CD1' ' A' ' 102' ' ' PHE . 29.6 mtpt -56.21 -34.69 66.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.927 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.403 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 5.5 t0 -63.43 -28.05 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -83.91 -22.95 31.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.202 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.516 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 8.8 t80 -73.86 -49.81 23.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.029 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.524 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 m-85 -51.88 -40.23 60.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.853 0.359 . . . . 0.0 111.239 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -85.07 -64.11 1.21 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.465 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -59.91 -49.27 78.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.58 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -109.26 37.02 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -164.39 168.1 38.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.6 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' HG11 ' A' ' 142' ' ' VAL . 85.8 m -61.55 154.99 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.69 0.281 . . . . 0.0 110.659 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -162.11 161.15 28.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 111.168 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.02 137.27 56.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.84 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.6 29.76 3.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -58.18 1.47 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.292 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 17.1 p -110.85 8.15 22.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.46 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 59.51 29.44 19.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.697 0.284 . . . . 0.0 111.069 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 tp -92.18 121.69 33.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.48 112.08 3.42 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.763 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.781 HG22 HD11 ' A' ' 15' ' ' LEU . 4.2 mt -71.77 132.92 84.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 76.1 Cg_exo -47.37 176.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.297 1.998 . . . . 0.0 112.592 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.03 -52.13 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.113 2.542 . . . . 0.0 113.632 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.9 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.03 22.02 7.39 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -55.88 -169.94 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.678 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.806 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -120.14 108.81 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.019 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.779 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.1 p -157.05 160.93 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.942 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.61 134.87 39.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.487 179.743 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.401 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -112.14 135.87 52.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.878 -179.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.829 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -71.21 96.67 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.977 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.65 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.359 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 138' ' ' ALA . 3.2 t70 -90.55 -46.07 8.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.782 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.644 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.462 HG11 ' CG2' ' A' ' 120' ' ' THR . 10.5 p -117.1 150.61 19.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.679 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.484 ' O ' HG21 ' A' ' 135' ' ' VAL . 27.5 m-85 -132.16 174.95 9.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.443 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -79.43 165.24 23.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.913 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.806 HD21 ' O ' ' A' ' 134' ' ' VAL . 3.3 mp -81.07 -32.32 34.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -91.36 -49.29 6.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.727 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.443 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 69.3 m -53.55 -29.6 37.71 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.127 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.788 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.89 114.68 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.086 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.529 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.19 154.24 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.035 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.56 149.96 28.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 152' ' ' VAL . 5.1 m -63.9 -28.22 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.402 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 151' ' ' VAL . 19.7 t -109.07 -56.7 4.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.338 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 31.7 m -65.92 -28.13 68.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.172 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.529 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 68.5 mttt 49.93 48.57 21.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.072 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -118.35 136.66 53.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.026 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.2 149.51 19.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.319 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.712 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -114.9 162.26 17.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.499 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 172.56 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 3.5 m -45.43 125.34 5.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.398 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.87 -22.76 37.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.694 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.461 ' C ' HG23 ' A' ' 9' ' ' VAL . 10.1 t70 -62.19 128.9 38.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 110.765 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 9' ' ' VAL . 56.5 mt-10 -87.98 123.42 32.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.94 0.4 . . . . 0.0 111.098 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.891 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -144.0 156.4 44.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.705 ' HB2' HG13 ' A' ' 172' ' ' VAL . 47.4 m-85 -108.62 171.1 7.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.829 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -125.31 121.34 33.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.853 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 6.7 mmt -81.6 166.97 19.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -65.86 -28.43 68.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -97.68 29.23 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.2 57.04 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.468 ' HB3' HG11 ' A' ' 151' ' ' VAL . 4.6 mtt180 -125.66 128.29 47.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' A' ' 163' ' ' PHE . 3.0 mp -78.6 133.29 37.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.705 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.5 p -145.06 137.27 21.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.935 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.6 p -81.56 169.13 17.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -59.13 -51.79 68.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.6 -25.47 52.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.293 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -96.81 -14.54 21.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.381 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.401 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 7.2 t80 -57.58 -66.0 0.54 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.371 . . . . 0.0 110.911 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.36 -28.49 70.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.139 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.9 m -75.33 -33.3 61.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.062 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -88.9 -49.58 6.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.216 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm 62.34 175.36 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.927 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.933 179.99 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 8' ' ' MET . 13.2 p . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.852 0.358 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.498 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -157.21 -170.61 3.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.667 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.5 p -155.04 147.59 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 157' ' ' LEU . 22.5 t -61.85 146.31 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.652 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.4 -163.54 10.49 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.521 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.69 130.04 84.26 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.449 0.166 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.892 ' HB2' HG12 ' A' ' 134' ' ' VAL . 25.2 Cg_exo -60.67 146.91 96.37 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.269 1.979 . . . . 0.0 112.399 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.13 160.56 24.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.465 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -144.02 173.58 11.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.066 0.46 . . . . 0.0 111.36 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -39.85 94.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.896 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.39 83.02 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.642 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.34 -126.01 3.24 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.32 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 170.51 -33.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 110.826 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 3.4 t80 69.18 161.67 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.869 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -111.02 127.14 8.1 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.627 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.575 ' OD1' HD11 ' A' ' 27' ' ' LEU . 9.5 t0 -84.05 -30.42 26.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.875 0.369 . . . . 0.0 110.936 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -58.07 -24.51 58.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.114 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.66 -30.13 54.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.06 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.446 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.9 OUTLIER -109.14 175.99 5.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.908 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.7 mmt85 -94.38 99.97 12.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.4 mm? -69.96 161.34 30.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.864 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.783 HG23 ' HB2' ' A' ' 101' ' ' CYS . 6.2 pt -62.99 138.52 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 m -100.52 106.84 18.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.2 mtm-85 -84.69 101.73 12.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.377 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -133.74 151.43 51.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.88 96.97 3.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.408 ' OD1' HD13 ' A' ' 31' ' ' LEU . 1.8 m120 -68.34 116.15 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -65.59 79.22 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -151.8 78.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -96.02 -31.49 13.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -127.42 115.66 19.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.125 179.939 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.688 0.28 . . . . 0.0 110.851 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.37 164.07 35.56 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.562 2.175 . . . . 0.0 112.209 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 59.08 31.61 21.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.857 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.624 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -106.56 134.7 19.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.112 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.438 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.9 Cg_endo -61.17 125.99 18.33 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.388 2.059 . . . . 0.0 112.084 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.9 139.81 30.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.069 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.7 p -57.54 164.14 2.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.958 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.42 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.31 114.61 23.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.481 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.06 -71.36 0.44 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.601 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.8 p -103.56 152.94 21.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.774 0.321 . . . . 0.0 110.981 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.45 87.2 2.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.11 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -178.79 135.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.624 ' CD2' HG21 ' A' ' 60' ' ' ILE . 10.9 p80 -71.39 143.47 50.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 70' ' ' ILE . 3.4 mm -68.76 147.62 12.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.515 HD23 ' ND1' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.7 35.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.929 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' HD11 ' A' ' 75' ' ' ILE . 2.0 m-20 -111.39 144.6 40.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.91 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -34.26 67.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.109 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.585 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.0 m-85 -106.19 112.03 24.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.585 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.6 mm -132.61 147.48 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -109.82 107.35 17.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.286 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -90.77 122.5 33.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.055 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.778 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -164.71 167.1 19.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.8 mt 62.95 37.04 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 29.18 17.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.065 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -170.62 -179.56 2.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 26.7 p-80 -97.99 124.45 42.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.972 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.776 ' CB ' HD13 ' A' ' 88' ' ' LEU . 42.2 m95 -116.54 130.8 56.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.779 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.71 172.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p -79.57 -40.62 29.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -91.0 -28.47 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.54 -31.15 68.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.993 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.776 HD13 ' CB ' ' A' ' 83' ' ' TRP . 5.2 tp -80.86 94.38 6.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.976 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -144.07 156.77 44.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 23.7 t -60.0 147.13 40.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.805 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.3 m -74.21 -28.88 61.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.173 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -101.39 -63.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.135 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.468 ' HB2' HG22 ' A' ' 95' ' ' VAL . 37.2 m -60.07 -30.69 69.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.097 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 57.31 23.18 8.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.468 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.0 m -85.81 156.31 58.38 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.247 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.57 118.93 5.96 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.525 2.15 . . . . 0.0 112.297 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -103.8 86.69 2.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -114.84 30.5 7.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.092 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.7 ' C ' HD11 ' A' ' 28' ' ' ILE . 41.2 mt-10 -140.03 -47.37 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.619 ' CB ' HD12 ' A' ' 27' ' ' LEU . 1.9 mpp_? -150.81 146.46 26.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.811 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.783 ' HB2' HG23 ' A' ' 28' ' ' ILE . 14.5 t -126.13 158.92 34.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.446 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.62 119.98 5.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 79' ' ' LEU . 17.8 p -139.11 150.86 46.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.24 124.0 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.828 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -114.4 4.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.535 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -123.87 32.99 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 0.0 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.2 m -157.69 166.89 31.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.5 p -129.33 115.98 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.077 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.2 OUTLIER -131.7 132.42 43.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -52.06 167.02 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 115' ' ' PHE . 1.7 mtmt -67.19 -30.43 70.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 4.8 t70 -55.2 -48.86 73.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -72.23 -20.9 61.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.051 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 118' ' ' PHE . 10.4 t80 -66.4 -41.05 89.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.951 0.405 . . . . 0.0 110.809 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.4 m-85 -67.77 -26.16 65.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.944 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -43.81 25.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.21 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 118' ' ' PHE . 14.4 ptp180 -79.27 -47.24 16.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.382 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 114' ' ' PHE . 76.3 m-85 -84.52 -43.02 14.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.99 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.94 167.89 40.57 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.574 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.8 m -59.58 152.93 20.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.6 172.24 14.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.069 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.2 t -63.77 138.57 58.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.71 29.53 2.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.995 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.22 -58.13 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.963 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 16.3 p -108.24 12.66 26.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.289 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 54.12 30.0 11.33 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.87 0.367 . . . . 0.0 111.083 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 144' ' ' HIS . 18.6 tp -94.1 138.65 31.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.909 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -65.4 130.79 34.98 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.734 HG23 HE21 ' A' ' 133' ' ' GLN . 22.3 mt -87.0 126.82 61.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.435 0.159 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.636 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 86.0 Cg_exo -44.43 173.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.72 2.28 . . . . 0.0 112.706 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.87 -55.12 0.22 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.866 2.377 . . . . 0.0 113.684 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.896 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.2 21.42 7.36 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.296 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.734 HE21 HG23 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -59.02 138.54 57.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.388 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.892 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.0 OUTLIER -78.14 108.64 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.988 0.423 . . . . 0.0 110.891 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.754 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.9 p -143.12 161.04 17.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.951 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.664 ' HD3' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -96.78 134.98 39.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.929 0.395 . . . . 0.0 110.822 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.19 157.89 16.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.956 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.759 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -100.6 96.75 7.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.756 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.475 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.38 -86.52 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.497 0.665 . . . . 0.0 111.821 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -100.22 -48.97 4.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.783 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -82.59 161.78 22.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.628 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.471 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.6 p -106.31 151.28 8.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.672 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.521 ' O ' HG21 ' A' ' 135' ' ' VAL . 19.5 m-85 -129.68 174.97 9.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.036 0.446 . . . . 0.0 111.394 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -78.0 160.73 27.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.773 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.664 HD12 ' HD3' ' A' ' 136' ' ' ARG . 16.3 tp -81.03 -31.3 34.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.857 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -91.27 -49.28 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.913 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.3 m -53.35 -30.14 37.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.231 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.725 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 1.3 t80 -56.84 116.16 3.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.099 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.16 -177.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.926 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.0 t -99.88 150.04 22.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.62 HG11 ' HG2' ' A' ' 170' ' ' ARG . 6.0 m -65.91 -26.37 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.314 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.616 HG23 HG23 ' A' ' 151' ' ' VAL . 25.7 t -107.89 -55.76 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.371 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.01 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 53.9 34.98 20.65 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.159 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -124.68 143.93 50.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.435 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.3 mt-30 -59.01 154.06 16.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.6 mm? -111.77 123.05 49.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -99.25 158.18 15.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.7 t -44.84 132.48 6.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.534 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 106.81 -32.38 7.32 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.548 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.513 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -71.02 133.61 46.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.834 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -87.97 116.12 25.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.027 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.814 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -126.5 144.65 50.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 5.0 m-85 -96.97 147.39 24.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.759 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -106.53 110.94 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.6 mmt -72.52 150.01 43.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -59.36 -28.76 67.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.012 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -97.48 36.2 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.996 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 3.1 p 49.97 83.6 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.184 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.62 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.7 OUTLIER -156.43 120.38 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.814 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -80.12 126.5 31.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.09 127.87 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 52.6 m -58.34 -173.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HE3' ' CE2' ' A' ' 164' ' ' TYR . 0.1 OUTLIER -72.8 -49.59 29.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -68.2 -44.12 76.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.119 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -58.81 -23.61 60.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.37 -65.97 0.5 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.46 -27.89 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.14 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.3 m -78.56 -30.44 46.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.065 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.88 16.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.257 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm 61.32 175.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.797 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.92 179.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.456 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.895 0.378 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.504 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -158.08 -175.87 5.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.527 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.463 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.0 p -155.03 131.82 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.185 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.473 HG23 ' CD1' ' A' ' 163' ' ' PHE . 57.8 t -55.71 146.3 5.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.667 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.501 ' C ' HG23 ' A' ' 159' ' ' THR . . . -127.5 -161.42 10.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.513 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -61.68 139.46 95.3 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.512 0.196 . . . . 0.0 110.759 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.3 Cg_exo -77.69 132.66 12.2 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.572 2.181 . . . . 0.0 112.193 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.02 155.74 25.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.2 mt -131.6 173.53 11.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.175 0.512 . . . . 0.0 111.525 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.527 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.6 -32.14 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.745 179.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.958 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.59 58.57 13.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.531 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -91.49 -75.34 1.3 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.563 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 65.56 77.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.478 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.8 OUTLIER -57.89 -170.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.65 -163.28 34.46 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.541 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -84.0 -31.84 25.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.753 0.311 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -59.58 -26.75 65.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.051 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.23 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.03 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 13.0 mm-40 -103.28 175.25 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.966 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -84.15 134.32 34.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.857 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 100' ' ' ARG . 3.0 mm? -95.43 165.01 12.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.969 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.691 HG23 ' HB2' ' A' ' 101' ' ' CYS . 9.4 pt -62.91 134.91 27.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.166 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -95.16 106.89 18.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.967 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.21 101.76 6.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.414 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.07 154.19 43.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -79.01 156.99 28.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -115.25 116.62 28.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.537 ' O ' HG23 ' A' ' 34' ' ' THR . 6.5 t -75.19 89.52 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.891 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.07 -73.43 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 68.13 -69.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.994 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.28 107.65 5.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.69 ' O ' HD22 ' A' ' 71' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.07 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.647 0.26 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.27 165.14 27.79 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.489 2.126 . . . . 0.0 112.146 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 58.66 30.03 19.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.794 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.508 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -103.57 135.33 19.39 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.431 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.1 Cg_endo -60.92 125.96 18.43 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.35 2.034 . . . . 0.0 112.062 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.99 163.55 22.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.088 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.3 t -73.82 154.71 39.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.575 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.55 114.65 21.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.498 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.65 -50.03 0.81 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.453 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.5 p -108.64 -179.0 3.74 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.847 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -108.0 75.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.012 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.25 132.5 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.508 ' CD2' HG21 ' A' ' 60' ' ' ILE . 9.3 p80 -63.85 134.84 55.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.491 HD13 ' HA ' ' A' ' 70' ' ' ILE . 4.7 mm -59.65 151.54 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.937 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.69 HD22 ' O ' ' A' ' 38' ' ' ALA . 0.6 OUTLIER -174.58 36.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.873 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -107.16 158.23 17.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -60.13 -74.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.6 121.15 24.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.995 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.2 mm -124.86 151.49 30.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.205 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 mp -109.74 106.98 16.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.392 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -90.75 124.38 35.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -159.04 159.9 35.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.13 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.834 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.9 OUTLIER 58.31 36.44 25.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.44 32.7 16.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.04 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 mtm-85 -170.02 169.93 7.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.447 ' CD2' HG13 ' A' ' 70' ' ' ILE . 21.4 p-80 -86.42 127.41 34.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.623 ' CB ' HD13 ' A' ' 88' ' ' LEU . 53.5 m95 -119.81 123.71 44.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.8 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.78 172.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.992 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -77.11 -47.8 19.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.855 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -85.91 -25.81 25.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 84.5 m -73.82 -28.2 61.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.775 HD23 ' O ' ' A' ' 97' ' ' LEU . 15.9 tp -80.79 90.17 5.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.002 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -143.71 154.83 43.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 8.4 t -59.85 147.06 39.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.847 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.4 m -73.51 -28.78 62.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.154 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -101.43 -63.05 1.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.189 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.525 ' HB2' HG22 ' A' ' 95' ' ' VAL . 30.0 m -59.83 -29.8 68.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.66 22.72 8.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.015 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.525 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.2 m -84.81 156.47 61.2 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.138 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.98 5.92 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.534 2.156 . . . . 0.0 112.366 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.775 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.1 mp -104.88 61.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.828 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.32 40.51 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.575 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.9 mm-40 -151.7 -46.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.693 ' HB3' HD12 ' A' ' 27' ' ' LEU . 40.6 mtm180 -148.23 143.61 27.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.834 ' SG ' HD21 ' A' ' 79' ' ' LEU . 51.3 t -119.16 156.05 30.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.99 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.444 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.82 119.97 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.775 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.408 ' HB2' HD22 ' A' ' 79' ' ' LEU . 1.2 t -96.73 160.53 14.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.448 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 0.0 OUTLIER -164.67 123.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.52 -131.86 51.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -98.85 31.62 2.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.885 0.374 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.3 m -162.66 173.73 13.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.797 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' HG13 ' A' ' 108' ' ' VAL . 13.8 p -102.15 115.86 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.35 120.94 36.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.857 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.1 p -60.33 172.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.13 -32.19 50.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.443 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -51.74 -57.99 7.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.424 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -74.15 -20.67 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.478 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 t80 -62.19 -26.36 68.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.94 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.443 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 3.7 m-85 -78.97 -39.61 33.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.036 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -85.04 -51.03 6.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.253 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 -73.35 -51.35 17.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.448 ' CE2' ' CD ' ' A' ' 104' ' ' ARG . 5.1 m-85 -102.79 37.04 2.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.108 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.65 162.96 32.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.449 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.48 ' CG2' HG11 ' A' ' 142' ' ' VAL . 74.8 m -58.76 152.16 19.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.761 0.315 . . . . 0.0 110.959 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 126' ' ' GLN . 0.1 OUTLIER -169.01 147.88 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.449 ' N ' HD11 ' A' ' 129' ' ' ILE . 38.0 t -65.44 130.84 44.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.922 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -95.67 23.45 6.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -41.61 2.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.978 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.9 m -106.94 -12.9 15.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.293 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER 63.95 30.27 14.23 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 0.0 110.784 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.411 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.9 tp -106.61 137.65 44.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.61 102.28 0.8 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.646 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.485 ' CD1' HG13 ' A' ' 142' ' ' VAL . 6.7 mt -60.26 140.38 91.39 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.493 0.187 . . . . 0.0 110.801 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.626 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 84.1 Cg_exo -47.34 173.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.468 2.112 . . . . 0.0 112.31 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.39 -54.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.47 2.113 . . . . 0.0 113.85 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.958 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -121.88 21.59 10.63 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 2.1 pt20 -59.02 140.01 56.21 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.512 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.732 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -80.12 108.74 13.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.934 0.397 . . . . 0.0 110.727 -179.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.2 p -154.64 158.91 3.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.218 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -96.91 137.98 35.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.653 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.85 131.09 54.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.768 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.583 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -59.76 96.53 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.662 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.506 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.5 OUTLIER 54.03 -86.47 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.391 0.615 . . . . 0.0 111.61 -179.69 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.9 m-20 -99.42 -48.47 4.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -80.63 166.59 20.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.585 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.485 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.7 p -127.15 157.24 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.647 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.583 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 22.7 m-85 -153.58 161.79 41.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.4 . . . . 0.0 111.324 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 77.0 m80 -60.62 145.4 49.15 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.308 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.511 ' CD2' HG23 ' A' ' 135' ' ' VAL . 0.3 OUTLIER -66.76 -17.95 65.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -81.94 -49.02 10.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.946 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 15.1 p -81.06 -29.87 34.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.172 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.672 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 20.0 t80 -63.08 99.07 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.84 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' A' ' 155' ' ' ARG . . . -162.0 175.28 11.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.098 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 47.1 t -78.72 150.21 32.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.723 HG11 ' NH1' ' A' ' 170' ' ' ARG . 34.5 m -72.26 -39.82 64.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.419 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.704 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -83.45 -57.23 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.549 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 35.2 m -65.89 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.9 34.36 23.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . 0.553 ' O ' ' HB1' ' A' ' 149' ' ' ALA . 54.0 mtm-85 -128.98 151.41 49.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -75.71 150.42 37.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.948 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.694 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.2 mm? -100.88 171.49 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.811 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.03 167.18 23.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.938 0.399 . . . . 0.0 111.275 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.501 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.2 m -43.27 129.14 4.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.644 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.19 -22.94 33.95 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.828 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.463 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.8 t0 -67.94 129.03 38.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.86 0.362 . . . . 0.0 110.81 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.427 ' HA ' HG23 ' A' ' 9' ' ' VAL . 32.2 mt-10 -88.02 123.64 32.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.033 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.58 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.3 p90 -141.45 162.39 35.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.072 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.539 ' HB2' HG13 ' A' ' 172' ' ' VAL . 50.9 m-85 -110.93 171.03 7.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.908 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.506 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.1 tp -131.77 110.97 11.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.9 mmt -73.53 -89.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.137 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -83.2 -49.2 9.69 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.84 0.352 . . . . 0.0 110.963 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -173.91 -59.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.675 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.411 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . 32.8 t -93.3 -22.99 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.723 ' NH1' HG11 ' A' ' 151' ' ' VAL . 2.9 mmm180 -56.41 102.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.13 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.672 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -91.51 125.77 36.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.826 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.656 HG23 ' OD2' ' A' ' 176' ' ' ASP . 11.8 p -145.03 123.36 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.066 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 5.1 m -66.76 -172.44 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.056 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.423 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 1.4 mtpm? -86.08 -35.99 19.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.776 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.59 67.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.091 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.704 ' HB2' HG21 ' A' ' 152' ' ' VAL . 3.8 p-10 -85.07 4.09 35.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.457 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 21.7 t80 -62.01 -65.98 0.61 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.059 0.457 . . . . 0.0 110.978 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -47.02 -28.63 1.74 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.492 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -30.57 57.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.975 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.06 -20.78 17.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.526 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.46 -178.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.816 -179.985 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.618 HG11 ' HE2' ' A' ' 174' ' ' LYS . 14.6 p . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.844 0.354 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -109.27 -165.37 1.01 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.363 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.536 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.4 p -155.06 144.7 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 0.0 111.369 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.445 HG13 ' HG3' ' A' ' 136' ' ' ARG . 47.8 t -62.06 146.1 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.169 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.68 -159.37 10.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.949 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -68.2 132.83 91.64 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.481 0.181 . . . . 0.0 110.9 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -65.25 145.15 83.25 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.343 2.029 . . . . 0.0 112.567 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.06 142.97 5.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.226 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -124.22 173.67 8.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.942 0.401 . . . . 0.0 111.28 -179.544 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.732 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -72.04 -39.17 69.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.132 -179.823 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 53.04 82.32 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.6 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.31 -51.31 0.25 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.532 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 62.45 -176.09 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 0.0 110.8 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.487 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -156.42 -75.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.64 144.73 14.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.596 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.512 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.8 p-10 -82.41 -30.97 29.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.02 -25.9 63.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.223 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -55.99 -68.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.131 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HG2' ' CE1' ' A' ' 102' ' ' PHE . 3.1 tp10 -75.64 173.45 11.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.02 100.0 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.852 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.696 HD11 ' CB ' ' A' ' 100' ' ' ARG . 2.5 tp -77.22 159.0 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.038 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.4 pt -62.95 127.58 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 m -88.11 106.84 18.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.799 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.08 101.83 11.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -146.09 153.37 40.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.991 -179.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -82.2 157.0 24.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -111.39 113.85 26.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.925 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.567 ' O ' HG23 ' A' ' 34' ' ' THR . 7.8 t -70.68 84.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -137.31 -74.77 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.955 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.97 -70.08 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.39 105.61 17.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.923 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.081 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.597 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.663 0.268 . . . . 0.0 110.897 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HD2' HG22 ' A' ' 57' ' ' THR . 60.8 Cg_endo -72.78 164.51 35.37 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.443 2.095 . . . . 0.0 112.262 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 57.09 28.51 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.754 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -96.83 135.03 22.35 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.451 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.0 Cg_endo -58.55 125.94 19.86 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.431 2.087 . . . . 0.0 111.994 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 136.14 33.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -58.24 164.17 2.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.904 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.649 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -89.48 114.63 26.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.37 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 128.05 -68.37 0.54 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.538 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 11.7 p -108.43 141.98 39.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.51 83.91 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.015 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 179.57 126.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.754 ' CD2' HG21 ' A' ' 60' ' ' ILE . 22.8 p80 -63.9 168.2 5.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.909 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.882 HD11 ' NE2' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -106.32 160.13 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.097 0.475 . . . . 0.0 110.818 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.21 35.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.292 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -99.24 -178.61 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.847 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -72.76 0.22 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.419 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -83.67 144.14 29.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.419 HD13 ' O ' ' A' ' 74' ' ' PHE . 37.0 mm -145.44 146.91 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.993 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -108.63 106.81 17.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.412 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -91.05 134.73 34.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -167.6 164.28 14.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.798 HD12 ' CE2' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 58.88 37.46 24.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.08 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.61 28.79 17.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -166.03 176.14 7.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.882 ' NE2' HD11 ' A' ' 70' ' ' ILE . 21.8 p-80 -94.09 128.8 40.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.798 ' CE2' HD12 ' A' ' 79' ' ' LEU . 42.2 m95 -119.64 133.2 55.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.725 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 171.72 0.27 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 t -80.05 -39.76 29.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.3 pttt -90.95 -29.08 17.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.13 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -67.65 -30.76 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.953 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.591 HD21 HG21 ' A' ' 28' ' ' ILE . 5.4 tp -68.43 75.8 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -120.73 136.82 54.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.841 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.26 135.3 57.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.4 m -80.1 -0.89 37.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.681 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 6.3 t0 -107.78 -63.02 1.36 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.716 0.293 . . . . 0.0 111.356 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.483 ' SG ' HG23 ' A' ' 95' ' ' VAL . 30.2 p -94.14 -21.09 19.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.456 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 59.11 39.76 22.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.9 0.381 . . . . 0.0 110.853 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.483 HG23 ' SG ' ' A' ' 93' ' ' CYS . 22.0 t -107.84 129.71 23.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.1 118.89 3.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.568 2.179 . . . . 0.0 112.479 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.677 HD23 ' O ' ' A' ' 100' ' ' ARG . 8.5 mp -85.18 -75.39 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.75 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 57.38 31.82 20.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.238 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.453 ' N ' HD11 ' A' ' 28' ' ' ILE . 6.4 mm-40 -156.45 -75.91 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.924 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.696 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -119.4 130.44 55.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.957 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.731 ' HB2' HG23 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -121.95 128.0 51.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.931 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.416 ' CE1' ' HG2' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -114.72 155.82 25.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.851 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.9 t -133.21 136.19 45.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.987 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -153.91 123.95 6.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.72 -60.58 4.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -176.54 -43.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 0.0 110.937 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 12.9 m -73.35 -170.77 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.0 p -113.03 122.91 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.06 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 92' ' ' ASP . 2.0 m-85 -119.26 155.79 31.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -102.39 149.24 24.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.706 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 2.5 mtmp? -54.57 -40.04 68.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.194 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -59.12 -29.53 67.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.923 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -84.12 -29.75 26.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.487 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 14.3 t80 -64.94 -30.22 71.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 3.5 m-85 -77.21 -41.22 42.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -81.35 -28.01 34.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 38.3 mmt180 -96.04 -55.47 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.22 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.451 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 12.4 m-85 -104.08 29.66 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.195 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.73 -151.14 5.7 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.278 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.732 HG21 ' SD ' ' A' ' 16' ' ' MET . 1.7 m -103.01 153.49 20.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.8 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -144.85 -164.99 2.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.958 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 32.4 t -116.5 139.05 50.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.958 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -104.96 24.97 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.28 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.434 ' HB2' ' CD1' ' A' ' 143' ' ' TYR . . . -125.13 -53.13 1.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.976 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.21 -16.57 13.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.247 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . 0.8 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.2 tt0 71.14 79.45 0.17 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.831 0.348 . . . . 0.0 111.01 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.8 HD12 ' O ' ' A' ' 126' ' ' GLN . 0.4 OUTLIER -156.72 133.82 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.646 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.34 99.83 0.11 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.726 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.612 HG23 ' HD2' ' A' ' 130' ' ' PRO . 59.0 mt -62.49 141.54 96.62 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.548 0.214 . . . . 0.0 110.769 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HD2' HG23 ' A' ' 129' ' ' ILE . 78.6 Cg_exo -42.83 168.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.736 2.291 . . . . 0.0 112.772 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -77.14 -55.64 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.926 2.417 . . . . 0.0 114.737 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.478 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 2.0 m -126.43 21.96 7.13 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -177.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 71.2 mm-40 -58.17 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.322 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.799 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -129.13 108.61 17.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.738 0.304 . . . . 0.0 111.112 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.4 p -143.49 157.68 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.74 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.476 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.48 134.96 39.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.064 0.459 . . . . 0.0 111.252 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.0 172.97 6.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.528 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -146.31 168.97 19.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.229 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.683 ' HG3' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 40.73 -83.82 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.55 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' A' ' 138' ' ' ALA . 21.7 t0 -162.09 38.12 0.12 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.732 0.301 . . . . 0.0 111.19 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.404 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . 0.6 OUTLIER -153.43 157.17 39.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.698 179.717 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.606 HG13 HD12 ' A' ' 129' ' ' ILE . 11.6 p -109.67 153.18 11.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.668 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.655 ' OH ' HD11 ' A' ' 165' ' ' LEU . 14.6 m-85 -143.47 147.54 34.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.023 0.44 . . . . 0.0 111.35 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 77.8 m80 -57.84 143.68 41.52 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.37 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.799 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -65.05 -17.93 64.87 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 176.761 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -82.53 -41.06 20.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.222 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.41 -25.79 20.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.636 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.542 ' CE1' HD21 ' A' ' 171' ' ' LEU . 2.1 t80 -60.54 91.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.84 0.352 . . . . 0.0 110.657 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.548 ' HB1' ' C ' ' A' ' 155' ' ' ARG . . . -167.78 174.25 7.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 49.5 t -76.23 150.25 37.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.612 HG11 ' CG ' ' A' ' 170' ' ' ARG . 6.4 m -74.89 -35.56 36.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.345 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.51 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -88.75 -57.55 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.412 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.8 m -65.86 -28.09 68.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.157 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt 60.31 38.72 19.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . 0.548 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 22.4 ttm-85 -128.96 145.14 51.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.028 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -78.29 155.94 29.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.028 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -106.46 168.72 8.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.675 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.04 166.94 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.315 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.5 m -43.37 122.04 2.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.539 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.73 -23.94 31.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.614 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.536 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.9 t0 -77.29 129.0 35.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.848 0.356 . . . . 0.0 110.88 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 33.3 mt-10 -87.98 121.65 30.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.941 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.651 ' CD2' HD23 ' A' ' 171' ' ' LEU . 17.8 p90 -131.07 179.04 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CZ ' ' HB ' ' A' ' 7' ' ' VAL . 0.7 OUTLIER -132.63 114.91 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.525 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.683 HD22 ' HG3' ' A' ' 139' ' ' GLN . 7.7 tt -93.73 110.81 22.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 0.0 110.51 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.19 159.95 33.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.76 -25.57 7.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.89 27.61 3.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.188 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 5.0 m 55.45 31.19 16.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.024 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.612 ' CG ' HG11 ' A' ' 151' ' ' VAL . 14.9 ttm180 -94.72 102.84 14.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -66.97 126.77 30.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.898 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.647 HG23 ' OD2' ' A' ' 176' ' ' ASP . 8.6 p -145.34 140.73 22.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.711 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.9 155.09 23.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.775 0.321 . . . . 0.0 110.963 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.618 ' HE2' HG11 ' A' ' 7' ' ' VAL . 8.7 mtmt -60.51 -30.16 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.769 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.35 -59.07 5.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.272 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.647 ' OD2' HG23 ' A' ' 172' ' ' VAL . 4.8 p-10 -81.39 -0.18 40.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.404 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.457 ' CZ ' ' HE2' ' A' ' 181' ' ' LYS . 8.7 t80 -61.67 -65.74 0.64 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.939 0.399 . . . . 0.0 110.657 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -57.21 -26.77 61.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.128 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 59.0 m -75.4 -22.84 57.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.339 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . 0.529 ' HB3' ' HZ3' ' A' ' 181' ' ' LYS . . . -97.01 -32.19 12.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . 0.529 ' HZ3' ' HB3' ' A' ' 180' ' ' ALA . 0.0 OUTLIER -171.93 -177.27 1.89 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.866 179.892 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 8' ' ' MET . 12.9 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.595 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -129.42 -175.04 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.723 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.519 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.6 p -154.98 134.48 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.16 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.443 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.0 t -58.15 146.12 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.46 -169.35 12.6 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.482 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -60.35 146.19 84.78 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.565 0.221 . . . . 0.0 110.687 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.876 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.4 Cg_exo -77.89 129.96 10.18 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.57 2.18 . . . . 0.0 112.238 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.75 154.61 35.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.441 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -138.73 173.72 11.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.143 0.497 . . . . 0.0 111.555 -179.631 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.444 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.69 -50.57 32.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.979 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.649 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 59.46 96.1 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.76 -66.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.562 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 60.79 95.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' CE1' ' A' ' 115' ' ' PHE . 11.0 p90 -58.71 -32.6 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.67 129.88 2.71 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.491 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.601 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.0 p30 -58.01 -28.38 64.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.737 0.304 . . . . 0.0 111.124 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -64.48 -51.13 64.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.114 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.43 -36.44 71.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.076 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.415 ' HG3' ' CE2' ' A' ' 102' ' ' PHE . 31.3 mm-40 -72.74 176.03 5.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.83 100.0 4.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.808 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -101.4 144.03 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.95 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.695 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.8 pt -63.01 148.15 11.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -118.02 106.88 13.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -77.23 101.86 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.642 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -138.49 160.22 40.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.018 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -74.3 119.63 18.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -59.45 -28.41 66.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.011 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m 63.48 34.14 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -130.53 76.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -98.66 31.41 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.924 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -152.15 78.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.095 -179.991 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.757 0.313 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -51.58 164.68 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.524 2.149 . . . . 0.0 112.334 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 59.24 31.36 21.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.573 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -109.97 134.91 20.55 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.448 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.9 Cg_endo -60.94 125.91 18.29 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.422 2.081 . . . . 0.0 112.122 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.59 140.6 29.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.074 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.8 164.29 2.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -85.83 114.63 22.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.33 -73.03 0.38 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.613 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -100.26 153.63 19.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.822 0.344 . . . . 0.0 111.004 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.08 86.51 2.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.03 133.6 0.12 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.573 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.4 p80 -70.55 161.0 31.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.59 ' C ' HD23 ' A' ' 71' ' ' LEU . 9.6 mm -94.5 153.67 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.99 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.925 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.12 170.27 7.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -74.18 0.33 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.673 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.94 91.7 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.661 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.603 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.95 140.79 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.603 ' H ' HD13 ' A' ' 75' ' ' ILE . 7.6 mp -89.87 106.9 18.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.584 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -90.77 115.02 27.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.564 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -156.5 156.78 34.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.275 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.817 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 61.69 36.34 16.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.056 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.18 29.9 17.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -168.21 -178.45 3.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.413 ' HB2' HD12 ' A' ' 75' ' ' ILE . 26.2 p-80 -100.11 125.29 46.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.817 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.0 m95 -114.34 132.82 56.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.826 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.454 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.64 172.2 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.12 -40.12 28.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -91.0 -29.78 17.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.22 -30.92 70.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.763 HD23 ' O ' ' A' ' 97' ' ' LEU . 9.7 tp -72.29 77.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -135.6 165.72 24.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.78 138.44 41.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.84 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -29.58 68.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.914 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -105.08 -59.79 1.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -61.43 -39.9 92.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 58.48 22.29 9.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.02 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.6 m -85.78 156.25 58.46 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.219 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -59.66 118.9 5.84 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.607 2.205 . . . . 0.0 112.159 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.8 mp -112.96 54.89 0.71 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.712 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.429 ' C ' HD11 ' A' ' 28' ' ' ILE . . . -97.76 30.21 3.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.138 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.448 ' N ' HD11 ' A' ' 28' ' ' ILE . 22.2 mt-10 -141.48 -47.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.85 135.7 38.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.695 ' HB2' HG23 ' A' ' 28' ' ' ILE . 1.5 t -121.44 170.94 9.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.502 ' CZ ' ' CD2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -176.97 120.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.609 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t -131.72 157.72 43.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.876 0.37 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -170.22 124.0 0.72 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.887 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 -94.27 1.96 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.497 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -147.87 36.01 0.85 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.801 0.334 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.6 m -159.42 -176.88 6.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.535 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.6 p -136.3 116.19 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.129 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -110.47 166.87 10.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 22.6 p -90.83 168.07 11.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.685 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 0.1 OUTLIER -56.35 -44.92 80.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.962 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 12.2 t70 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -77.82 -21.0 52.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.35 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.502 ' CD2' ' CZ ' ' A' ' 102' ' ' PHE . 11.6 t80 -67.99 -44.08 77.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.368 . . . . 0.0 110.891 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 18.1 m-85 -60.67 -41.4 95.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -81.27 -30.43 34.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.351 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -80.96 -54.05 5.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.288 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -105.58 -43.09 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.104 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.53 164.71 11.28 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.487 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 16' ' ' MET . 85.8 m -60.72 155.08 19.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.774 0.321 . . . . 0.0 110.719 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -140.28 172.51 12.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.07 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.492 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.6 t -85.34 130.57 34.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.17 28.42 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.739 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.16 -53.76 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.78 -16.09 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.234 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.8 71.74 0.42 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.898 0.38 . . . . 0.0 110.81 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.437 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -128.09 -164.57 1.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -104.72 107.03 2.82 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.721 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.654 ' CG2' HD11 ' A' ' 15' ' ' LEU . 8.5 mt -87.89 127.35 58.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.4 0.143 . . . . 0.0 110.622 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 52.1 Cg_exo -53.14 177.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.241 1.96 . . . . 0.0 112.316 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.23 -49.16 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.082 2.522 . . . . 0.0 113.554 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.649 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.6 m -126.07 21.9 7.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.612 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -53.35 -175.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.328 . . . . 0.0 110.692 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.928 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -125.48 109.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 111.069 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.653 HG21 ' O ' ' A' ' 143' ' ' TYR . 14.5 p -156.95 160.34 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.87 138.13 34.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.652 179.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.412 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.3 OUTLIER -104.91 136.01 45.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.979 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.6 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.83 96.65 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.556 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 54.38 -87.16 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.087 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -96.88 -48.17 5.55 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.823 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.679 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.3 m-85 -84.4 163.01 19.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.644 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.43 HG11 ' CD1' ' A' ' 129' ' ' ILE . 9.9 p -108.62 151.31 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.708 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.739 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -129.01 170.21 13.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.945 0.403 . . . . 0.0 111.299 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.7 m80 -97.56 140.19 32.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.955 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.928 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.07 -21.26 44.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -91.13 -38.66 12.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.306 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -98.73 12.45 35.48 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.864 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 53.5 t80 -101.56 101.63 12.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -158.94 177.76 10.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 45.2 t -86.48 150.18 24.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.605 HG11 ' HG2' ' A' ' 170' ' ' ARG . 27.6 m -72.17 -36.69 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.317 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.597 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -88.4 -56.94 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.498 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.6 m -65.87 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.159 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? 59.66 32.84 21.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.943 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -128.97 153.01 47.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.03 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.594 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.8 mt-30 -72.16 174.54 7.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.714 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -128.12 173.31 10.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.847 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 163.51 35.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.963 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.2 t -46.8 129.36 11.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.245 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 101.85 -25.31 28.38 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.464 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.519 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.6 t70 -70.45 129.18 38.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.821 0.343 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.95 122.0 31.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.04 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.595 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 5.4 p90 -139.25 155.45 47.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.955 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.451 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 34.4 m-85 -103.02 171.08 7.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.612 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.6 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -130.3 114.46 15.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.4 mmt -70.73 -178.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.11 -28.71 60.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -97.58 28.96 3.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.057 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.07 43.63 24.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.021 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.605 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.1 OUTLIER -100.72 124.09 45.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.864 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -74.66 120.83 20.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.726 HG23 ' OD2' ' A' ' 176' ' ' ASP . 12.5 p -145.3 127.39 9.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.1 m -72.34 -173.19 1.05 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.889 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.435 ' CE ' HG21 ' A' ' 7' ' ' VAL . 12.7 mttt -85.94 -32.24 21.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.84 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.42 -52.33 54.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.15 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.726 ' OD2' HG23 ' A' ' 172' ' ' VAL . 7.2 p-10 -85.21 3.98 36.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.429 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.451 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.6 t80 -59.17 -66.05 0.57 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.964 0.411 . . . . 0.0 110.763 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.32 -27.89 57.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 85.9 m -77.83 -35.43 51.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . 0.499 ' HB2' ' CG2' ' A' ' 152' ' ' VAL . . . -97.11 4.04 51.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.579 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.3 -177.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 110.862 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.914 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 12.0 p . . . . . 0 N--CA 1.457 -0.096 0 CA-C-O 120.851 0.358 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.07 -177.12 5.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.69 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.557 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.4 p -154.97 135.09 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.141 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 163' ' ' PHE . 47.9 t -59.27 146.17 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.63 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.88 -169.11 11.98 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.482 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.4 mm-40 -56.3 135.5 75.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.549 0.214 . . . . 0.0 110.744 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.636 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.2 Cg_exo -64.54 135.62 46.54 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.382 2.054 . . . . 0.0 112.385 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -162.94 147.69 11.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.544 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.757 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -117.77 173.35 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.109 0.48 . . . . 0.0 111.285 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.62 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -60.58 -36.24 78.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.721 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.916 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 57.66 74.88 0.29 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.09 -60.96 0.48 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.478 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 62.61 97.68 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.494 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -59.22 -166.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.899 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.43 147.44 19.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -84.03 -35.74 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.98 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -89.5 7.12 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.18 -31.22 34.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 33.4 tp10 -109.66 164.25 12.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -75.97 99.96 4.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.951 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 101' ' ' CYS . 2.0 tp -79.72 165.07 23.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.813 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.6 pt -62.89 164.16 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.464 HG22 ' HG ' ' A' ' 31' ' ' LEU . 59.5 m -126.82 107.07 9.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.774 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.99 101.78 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.547 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.09 151.26 36.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.952 -179.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -82.04 156.97 24.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -115.7 144.44 43.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 p -96.85 40.02 1.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 38' ' ' ALA . 0.2 OUTLIER -87.53 -70.29 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 63.7 -79.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.007 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -69.82 -75.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.414 ' HB2' ' CG ' ' A' ' 35' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.132 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.742 0.306 . . . . 0.0 110.965 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.45 169.0 18.09 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.534 2.156 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 58.41 29.09 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.834 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.581 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.2 tp -99.49 135.5 20.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 11.8 Cg_endo -56.39 125.93 20.65 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.407 2.071 . . . . 0.0 112.047 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.12 137.94 31.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.3 p -58.37 164.22 2.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.881 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.25 114.63 24.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.27 -71.48 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.66 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.5 p -103.48 155.68 18.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.37 88.3 3.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.112 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -178.44 136.62 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.581 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.8 p80 -73.67 157.13 37.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.009 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.528 HD11 ' CD2' ' A' ' 84' ' ' HIS . 3.9 mm -88.77 151.55 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.92 37.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.019 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -103.36 179.91 4.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -39.8 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.713 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -109.21 110.22 21.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.446 HG22 ' N ' ' A' ' 76' ' ' LEU . 40.9 mm -120.0 154.79 22.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.389 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.446 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.53 107.06 15.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.093 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.7 119.0 30.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.01 162.71 41.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.148 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.733 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 57.01 36.32 27.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 62.54 30.38 17.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.009 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 21.0 mtt180 -164.2 -178.99 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.015 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.405 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 32.9 p-80 -98.8 121.24 40.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.022 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.733 ' NE1' HD12 ' A' ' 79' ' ' LEU . 46.1 m95 -112.48 130.46 55.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.528 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.39 171.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.881 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -79.93 -41.08 26.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.991 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -89.77 -28.61 19.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.016 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.83 -30.78 68.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 97' ' ' LEU . 8.1 tp -72.14 80.39 0.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mmtt -144.63 141.12 29.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.914 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 11.6 t -59.8 132.45 54.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.1 m -77.85 -4.3 45.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.504 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -111.31 -31.8 6.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.065 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 95' ' ' VAL . 14.1 m -111.87 -30.48 7.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.149 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 9.9 t-160 60.77 25.26 15.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.944 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 93' ' ' CYS . 3.5 m -85.27 159.84 55.61 Favored Pre-proline 0 N--CA 1.453 -0.299 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.213 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.494 ' O ' HD12 ' A' ' 97' ' ' LEU . 35.7 Cg_exo -59.9 121.2 9.45 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.685 2.257 . . . . 0.0 112.312 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.669 ' O ' HD23 ' A' ' 88' ' ' LEU . 5.6 mp -124.55 30.48 5.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.698 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.49 61.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.555 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.813 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.4 mt-10 -92.04 -39.9 11.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.994 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.465 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -140.17 170.74 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.893 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.742 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.3 t -150.89 156.16 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.8 t80 -157.94 119.91 3.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.79 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.466 ' HB3' HD22 ' A' ' 79' ' ' LEU . 10.8 t -130.83 162.27 29.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 4.2 mmm-85 -153.63 124.04 7.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.77 -78.54 0.74 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -133.91 -74.29 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.778 0.323 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 m -59.8 164.66 3.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.537 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.3 p -107.3 115.93 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.65 120.89 39.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.799 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 27.3 p -60.09 170.51 1.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.11 -31.88 50.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.196 -179.739 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -50.82 -58.01 7.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.438 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.53 -20.97 58.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.494 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 9.5 t80 -60.14 -26.97 66.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.675 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -79.28 -44.3 21.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.956 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -85.29 -62.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.721 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.05 -50.77 72.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.78 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 6.0 m-85 -88.29 -43.03 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.684 0.278 . . . . 0.0 111.362 -179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.76 -168.36 36.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.432 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.62 HG21 ' SD ' ' A' ' 16' ' ' MET . 24.3 m -58.95 148.69 29.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -151.38 162.22 41.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.803 ' HB2' HD11 ' A' ' 129' ' ' ILE . 42.5 t -79.83 127.6 32.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.943 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.55 30.67 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -124.99 -56.39 1.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.058 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.74 -22.43 11.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.11 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 71.47 73.22 0.18 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.957 0.408 . . . . 0.0 110.912 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.443 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -128.53 -164.54 1.39 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.807 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -109.38 106.11 2.16 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.616 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.803 HD11 ' HB2' ' A' ' 122' ' ' CYS . 2.4 mt -94.97 128.02 40.75 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.448 0.166 . . . . 0.0 110.657 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.619 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.7 Cg_exo -52.25 175.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.196 1.931 . . . . 0.0 112.197 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.37 -47.3 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.646 2.23 . . . . 0.0 113.871 -179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.916 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.53 21.91 7.73 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.177 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.654 HE21 HG23 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -56.73 -170.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.594 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.636 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.15 108.66 23.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.751 0.31 . . . . 0.0 110.544 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.757 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.2 p -157.19 161.72 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.167 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.543 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 135.06 39.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.246 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.722 ' HB3' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -115.65 144.43 43.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.088 -179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.815 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -84.45 96.67 9.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.44 -89.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.529 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.1 m-20 -84.61 -44.5 13.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.749 -177.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 169' ' ' SER . 7.2 m-85 -91.64 167.21 12.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.473 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.722 HG23 ' HB3' ' A' ' 137' ' ' ARG . 9.3 p -124.61 119.78 57.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.901 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 6.0 m-85 -102.98 138.7 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.443 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 64.4 m80 -60.82 141.27 57.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.677 HD23 ' HB ' ' A' ' 135' ' ' VAL . 0.4 OUTLIER -61.29 -18.79 60.23 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.433 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -88.24 -36.7 16.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.912 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.9 OUTLIER -100.89 21.27 13.94 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.447 -179.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.702 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 5.6 t80 -89.8 109.75 20.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.841 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.08 157.71 4.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.959 0.409 . . . . 0.0 111.259 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.16 150.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 171' ' ' LEU . 10.8 m -91.09 22.47 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.508 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 39.2 t -136.74 -62.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.813 0.339 . . . . 0.0 110.618 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.9 p -85.02 -20.83 29.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.653 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 65.01 61.75 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.193 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -129.13 137.58 51.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.071 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 157' ' ' LEU . 13.5 mt-30 -68.17 154.06 42.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.725 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.4 OUTLIER -122.68 147.1 46.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.64 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -127.54 165.89 19.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.0 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -46.05 128.2 9.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.206 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.17 -26.67 22.24 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.557 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.5 m-20 -70.82 128.96 37.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.813 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -87.99 118.84 27.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.035 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.686 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.2 p90 -135.63 151.28 50.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 174' ' ' LYS . 26.0 m-85 -97.06 171.01 8.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.795 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.815 HD11 ' HB1' ' A' ' 138' ' ' ALA . 2.8 tp -132.22 118.39 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.782 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.7 mmt -56.38 164.26 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -58.2 -30.46 66.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.159 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.92 -79.04 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.994 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . 0.437 ' HB3' ' CE1' ' A' ' 141' ' ' PHE . 36.5 p 178.99 77.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.804 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.582 ' CG ' HG11 ' A' ' 151' ' ' VAL . 7.6 mtt180 -144.5 119.38 9.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.702 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -66.92 121.43 15.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.841 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -139.09 140.76 37.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.001 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.31 160.99 14.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 164' ' ' TYR . 9.4 mttp -58.12 -46.84 84.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.136 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.35 -27.15 62.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.308 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -104.07 -6.87 20.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.447 ' CE2' ' CB ' ' A' ' 182' ' ' GLN . 8.3 t80 -56.2 -66.04 0.5 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.843 0.354 . . . . 0.0 110.986 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.6 -31.37 72.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.928 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -31.5 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.873 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -78.29 -52.02 9.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.13 -67.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.947 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . 0.447 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.922 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.487 HG22 ' N ' ' A' ' 8' ' ' MET . 14.2 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.784 0.326 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.597 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -140.95 179.18 6.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.716 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.523 HG23 ' C ' ' A' ' 161' ' ' ASP . 7.3 p -155.11 133.81 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.1 t -54.8 146.31 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.662 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.488 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -143.23 -140.76 3.73 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.702 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 24.3 mt-10 -72.96 117.04 56.47 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.527 0.204 . . . . 0.0 110.865 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.92 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.03 137.51 52.87 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.388 2.059 . . . . 0.0 112.115 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.05 153.96 16.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.787 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.814 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -124.86 173.47 8.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.109 0.481 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.408 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.09 -28.42 68.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.692 179.588 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.926 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.35 61.05 7.82 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.527 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.65 -67.13 1.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.545 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 65.92 67.72 0.47 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.946 0.403 . . . . 0.0 110.739 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -75.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.03 153.8 30.59 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.06 -34.19 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -62.05 -31.17 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -68.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 102' ' ' PHE . 67.5 mm-40 -65.1 175.99 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 119.05 19.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.44 HD11 ' CB ' ' A' ' 100' ' ' ARG . 1.7 tp -103.68 165.05 11.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.914 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.853 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.9 pt -62.88 146.89 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.168 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.6 m -113.62 106.86 15.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 76' ' ' LEU . 1.3 tpp180 -77.61 101.83 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.59 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.05 166.06 26.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.961 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.43 157.03 23.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.1 -29.1 9.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.885 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.71 36.84 13.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.915 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -133.83 77.45 1.71 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 73' ' ' ARG . 47.1 m-85 -80.62 -74.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.87 86.43 4.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.061 -179.978 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.101 0 CA-C-O 120.655 0.264 . . . . 0.0 110.835 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.95 165.86 1.09 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.522 2.148 . . . . 0.0 112.173 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 58.3 30.56 19.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.833 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.496 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -107.45 135.22 19.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.991 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.429 ' HD2' HD12 ' A' ' 60' ' ' ILE . 21.9 Cg_endo -62.27 125.9 17.37 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.359 2.04 . . . . 0.0 112.021 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.79 150.69 22.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.7 t -58.52 140.51 53.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.711 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -62.1 114.85 3.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.71 28.77 45.62 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.98 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.65 -178.9 5.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.876 0.369 . . . . 0.0 110.849 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.6 -28.35 10.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.52 -167.58 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.496 ' CD2' HG21 ' A' ' 60' ' ' ILE . 6.2 p80 -107.54 171.76 7.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.971 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.513 ' C ' HD23 ' A' ' 71' ' ' LEU . 10.4 mm -91.57 153.48 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.059 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.513 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.84 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.826 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.586 ' HB2' HD11 ' A' ' 75' ' ' ILE . 11.1 m-20 -100.36 -178.9 3.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.926 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 36' ' ' PHE . 15.2 tpt180 -86.88 -70.11 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.986 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.596 ' C ' HD12 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -81.35 105.66 12.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.111 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.596 HD12 ' C ' ' A' ' 74' ' ' PHE . 1.3 mp -113.12 153.8 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.825 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 30' ' ' ARG . 8.6 mp -104.79 111.95 24.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.797 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -90.95 139.03 31.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.982 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -176.7 150.59 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.119 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.75 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.3 OUTLIER 58.64 37.26 25.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 62.09 30.35 17.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.111 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -166.33 167.97 15.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.895 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -92.45 117.96 30.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.646 ' CB ' HD13 ' A' ' 88' ' ' LEU . 69.3 m95 -105.73 125.13 50.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.67 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 175.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.955 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t -77.29 -42.08 38.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.898 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 ttpm? -91.14 -34.09 15.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 30.6 m -67.48 -28.2 67.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 83' ' ' TRP . 48.7 tp -72.8 89.18 1.35 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.908 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.3 mttt -152.93 155.94 37.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -59.9 146.97 40.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 m -73.1 -30.98 64.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 -60.51 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.96 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.414 ' HB2' HG22 ' A' ' 95' ' ' VAL . 35.2 m -59.73 -34.25 72.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 57.77 22.25 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.097 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.442 HG23 HD11 ' A' ' 97' ' ' LEU . 4.2 m -85.18 156.33 60.13 Favored Pre-proline 0 N--CA 1.453 -0.284 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.38 118.97 6.0 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.471 2.114 . . . . 0.0 112.253 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.568 ' O ' HD23 ' A' ' 88' ' ' LEU . 11.2 mp -111.43 60.8 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.85 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.68 36.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.081 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -153.42 -46.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.881 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.44 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -128.4 138.57 52.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.919 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.853 ' HB2' HG23 ' A' ' 28' ' ' ILE . 49.4 t -131.06 156.97 44.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 104' ' ' ARG . 13.5 t80 -169.08 119.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.74 ' HB2' HD22 ' A' ' 79' ' ' LEU . 10.7 t -97.27 153.18 18.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.44 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -176.71 124.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.871 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.89 41.07 24.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 59.52 31.4 20.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.857 0.361 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.6 m -161.62 165.79 27.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.858 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.543 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.7 p -85.47 115.99 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.058 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -125.63 120.93 32.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.935 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.1 p -69.9 163.61 25.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -78.14 -24.96 47.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.353 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.436 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -55.56 -58.16 8.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 111.284 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -73.32 -20.75 60.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.254 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.444 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 32.9 t80 -61.98 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.7 m-85 -72.88 -44.79 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -79.89 -31.85 40.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.055 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -57.84 2.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.062 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 23.8 m-85 -99.04 31.13 3.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.973 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.14 169.06 32.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.404 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 86.2 m -59.78 153.56 20.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.765 0.317 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -154.9 170.66 21.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.03 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 18.8 t -81.22 137.96 35.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.82 14.03 16.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.51 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.09 -41.54 2.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.937 0.399 . . . . 0.0 111.064 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.8 m -105.9 -20.58 13.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.095 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 64.31 29.27 13.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.746 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tp -99.58 150.02 22.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.812 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.93 96.59 0.6 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.652 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.458 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 5.2 mt -59.86 140.32 90.02 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.478 0.18 . . . . 0.0 110.678 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.645 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.6 Cg_exo -48.24 175.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.301 2.001 . . . . 0.0 112.11 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.443 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.5 Cg_endo -77.38 -55.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.365 2.043 . . . . 0.0 113.948 -179.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.926 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -122.36 21.72 10.23 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.645 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.9 OUTLIER -60.07 139.07 57.71 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.649 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.92 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -74.89 108.71 6.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.826 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.814 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.0 p -151.78 161.07 3.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.12 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.81 141.86 29.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.859 0.361 . . . . 0.0 110.591 179.858 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.56 ' HG2' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.87 130.03 53.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.975 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.695 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -82.56 96.67 8.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.739 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.628 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.86 -86.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.451 0.644 . . . . 0.0 111.855 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -100.23 -48.41 4.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.954 -177.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -91.34 174.67 7.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.759 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.56 HG22 ' HG2' ' A' ' 137' ' ' ARG . 32.5 t -121.43 150.23 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.703 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.695 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 2.6 m-85 -131.34 138.99 49.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.423 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 70.1 m80 -55.12 144.93 22.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.846 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -64.3 -17.85 64.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.225 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.93 -38.34 14.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.078 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.8 p -95.48 25.21 4.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.531 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.832 ' CE1' HD11 ' A' ' 171' ' ' LEU . 0.9 OUTLIER -104.36 112.24 25.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.8 0.333 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.442 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.03 160.59 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.123 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -59.7 150.04 28.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 152' ' ' VAL . 6.5 m -67.31 -27.31 38.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.343 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 151' ' ' VAL . 20.1 t -108.54 -55.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.36 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 40.3 m -66.04 -28.0 68.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.078 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . 0.442 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 9.8 mmtt 55.21 36.78 27.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.997 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -109.8 137.79 47.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.2 mt-30 -64.02 154.42 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.0 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.696 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.4 mm? -113.79 163.85 14.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.703 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 170.92 15.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.488 HG23 ' HA2' ' A' ' 11' ' ' GLY . 4.4 m -44.69 123.03 3.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.501 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.92 -24.36 32.56 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.679 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.523 ' C ' HG23 ' A' ' 9' ' ' VAL . 5.0 t0 -67.07 128.98 38.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.744 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.482 ' HA ' HG23 ' A' ' 9' ' ' VAL . 5.1 mt-10 -87.87 128.95 35.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.142 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.597 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 12.5 p90 -143.43 141.11 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.601 ' HB2' HG13 ' A' ' 172' ' ' VAL . 14.8 m-85 -97.96 171.07 8.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.796 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.628 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.5 tp -131.73 110.99 11.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.792 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 5.7 mmt -60.98 172.32 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -66.11 -30.22 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -98.21 29.18 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.44 84.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.974 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.434 ' CG ' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -149.49 129.54 13.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.914 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.832 HD11 ' CE1' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -73.74 126.11 29.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.601 HG13 ' HB2' ' A' ' 164' ' ' TYR . 11.3 p -145.06 135.75 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 29.6 p -80.29 167.23 20.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.875 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -57.54 -49.64 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.066 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.6 63.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -94.98 -15.45 23.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.261 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 7.7 t80 -55.58 -66.04 0.49 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.053 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.2 -29.5 70.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 4.3 m -72.81 -33.3 66.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.029 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.6 -30.88 15.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.201 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm 61.44 175.77 0.11 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.956 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.495 HG22 ' N ' ' A' ' 8' ' ' MET . 14.0 p . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.794 0.331 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.495 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -131.53 -175.62 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.7 p -155.03 139.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.263 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.465 HG22 ' CE1' ' A' ' 163' ' ' PHE . 39.8 t -66.55 146.09 13.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.665 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.01 -167.21 12.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.49 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 11.0 mt-10 -62.58 149.84 87.63 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.628 0.251 . . . . 0.0 110.832 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.1 Cg_endo -83.01 136.08 7.86 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.848 2.365 . . . . 0.0 112.399 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.06 142.89 5.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.301 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.752 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -117.95 173.46 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.409 -179.639 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.62 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.27 -44.21 92.46 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.005 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.831 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 60.13 102.45 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.436 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.12 -44.69 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.567 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 62.77 20.51 12.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.66 0.267 . . . . 0.0 110.978 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.496 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 55.54 -173.95 0.05 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.822 0.344 . . . . 0.0 111.047 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.57 152.32 16.84 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.1 -31.08 25.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.912 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -88.14 7.05 33.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.427 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.85 -67.97 0.42 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.9 tp10 -110.83 176.06 5.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.907 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 136.89 40.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mp -111.96 165.06 12.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.874 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.759 HG21 HD21 ' A' ' 88' ' ' LEU . 6.5 pt -62.94 135.19 27.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -99.24 106.87 19.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.741 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD2' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.64 101.83 11.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.471 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.461 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.47 163.03 35.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.986 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -86.59 150.9 23.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.931 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -98.31 -31.37 12.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.936 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 m 60.26 31.66 20.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.31 -73.09 0.49 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 73' ' ' ARG . 5.2 m-85 64.17 -78.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.983 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -74.94 111.49 10.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 179.967 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.112 0 CA-C-O 120.667 0.27 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.38 165.64 26.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.175 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 58.36 29.82 18.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.767 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.454 HG21 ' CD2' ' A' ' 69' ' ' HIS . 2.9 tp -103.02 135.66 19.36 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' HD12 ' A' ' 60' ' ' ILE . 19.3 Cg_endo -59.88 125.92 19.01 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.408 2.072 . . . . 0.0 111.891 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.55 149.01 21.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.4 t -58.22 137.39 57.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.705 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.448 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -61.06 114.76 3.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.266 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.47 28.38 39.91 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.914 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.54 -178.86 5.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.837 0.351 . . . . 0.0 110.96 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.9 -28.79 9.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.691 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.26 -165.94 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.703 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.454 ' CD2' HG21 ' A' ' 60' ' ' ILE . 7.4 p80 -110.76 154.56 23.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.7 mm -66.92 153.72 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.404 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.4 OUTLIER -168.83 33.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.783 -179.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -109.38 -178.97 3.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -95.13 -35.73 11.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.582 ' O ' HD13 ' A' ' 75' ' ' ILE . 1.9 m-85 -105.03 115.68 30.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.055 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.1 mm -133.62 153.88 37.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.229 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.9 mp -113.18 107.93 16.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.278 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -90.77 123.21 34.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.043 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.725 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.48 162.19 35.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.051 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.65 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 57.85 35.47 25.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.47 40.76 10.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.02 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.45 171.13 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -93.2 117.92 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.65 ' NE1' HD12 ' A' ' 79' ' ' LEU . 73.5 m95 -109.72 125.41 52.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.791 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 176.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.957 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.01 -42.01 24.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.13 -15.56 29.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.113 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.5 m -96.74 26.16 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.734 0.302 . . . . 0.0 111.083 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.759 HD21 HG21 ' A' ' 28' ' ' ILE . 2.8 tp -124.06 29.55 6.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 152.21 20.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.16 147.03 52.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -66.56 -29.61 69.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.032 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -106.13 -58.38 1.92 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 17.0 m -59.92 -37.67 80.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 58.0 22.58 9.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.028 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -87.01 155.9 55.12 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.151 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.21 118.94 5.75 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.513 2.142 . . . . 0.0 112.339 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.457 HD23 ' SG ' ' A' ' 101' ' ' CYS . 8.8 mp -101.81 70.69 1.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.89 35.19 1.75 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.108 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.545 ' C ' HD11 ' A' ' 28' ' ' ILE . 31.2 mm-40 -152.42 -48.51 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -149.41 157.76 43.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.909 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HD23 ' A' ' 97' ' ' LEU . 20.0 t -157.02 128.0 6.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.9 m-85 -98.45 171.96 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.562 ' HB2' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -155.59 140.43 17.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.874 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -153.64 124.0 7.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.818 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.34 -122.84 15.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.536 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -113.07 36.08 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 165.53 29.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.3 p -117.07 116.0 50.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.13 159.38 21.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.7 p -100.92 176.76 5.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.793 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.16 -29.44 48.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.332 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.79 -58.05 9.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -71.27 -20.89 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.293 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 5.9 t80 -65.67 -30.11 70.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 111.144 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 4.0 m-85 -79.08 -44.44 22.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.1 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -79.26 -41.8 27.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.212 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -83.02 -55.72 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.259 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -96.99 37.07 1.34 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.914 0.387 . . . . 0.0 111.139 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -156.45 -167.38 17.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.455 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.612 HG21 ' SD ' ' A' ' 16' ' ' MET . 2.4 m -59.79 150.05 29.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.786 0.327 . . . . 0.0 110.902 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -153.65 175.5 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.882 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.614 ' HB2' HD11 ' A' ' 129' ' ' ILE . 47.2 t -88.0 132.1 34.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.992 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.4 27.45 4.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.037 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.87 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -55.34 1.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.964 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 23.7 p -111.16 -17.44 13.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.169 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 66.45 73.68 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.873 0.368 . . . . 0.0 110.882 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.453 ' CB ' ' CE1' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -127.97 -163.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.731 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -111.34 97.0 0.92 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.734 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.701 HG22 HD11 ' A' ' 15' ' ' LEU . 1.7 mt -82.03 129.31 64.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.426 0.155 . . . . 0.0 110.63 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 77.5 Cg_exo -48.5 173.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.281 1.987 . . . . 0.0 112.337 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.1 Cg_endo -77.48 -47.54 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.558 2.172 . . . . 0.0 113.892 -179.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.831 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.2 m -126.22 21.85 7.29 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -56.18 -171.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.539 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.766 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -121.02 108.3 22.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.782 0.325 . . . . 0.0 110.554 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.752 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.6 p -157.41 156.06 4.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.276 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.45 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.68 139.24 33.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.59 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.85 129.43 53.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.92 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -64.41 96.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.515 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.45 -88.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.857 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -88.8 -42.15 12.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.991 -1.004 . . . . 0.0 112.53 -177.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 5.2 m-85 -99.58 166.34 11.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.052 0.453 . . . . 0.0 112.12 -178.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.1 p -105.17 147.48 10.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.633 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.87 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 17.8 m-85 -132.62 142.59 49.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.881 0.372 . . . . 0.0 111.353 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 127' ' ' LEU . 66.4 m80 -70.4 145.08 51.33 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.02 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.766 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.2 OUTLIER -64.97 -17.74 64.66 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.228 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -88.48 -46.48 9.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.544 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 2.5 p -84.83 -33.73 22.83 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.806 ' CE1' HD21 ' A' ' 171' ' ' LEU . 36.8 t80 -56.99 99.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.88 0.371 . . . . 0.0 110.972 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.01 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.108 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 150.01 26.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.943 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.836 HG13 ' O ' ' A' ' 171' ' ' LEU . 23.7 m -70.44 -30.56 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.154 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.784 HG23 HG23 ' A' ' 151' ' ' VAL . 19.8 t -106.99 -51.5 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.125 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 42.5 m -66.05 -28.14 68.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 24.0 mttp 54.84 39.62 31.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.03 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -127.84 141.83 51.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.907 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.497 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.8 mt-30 -61.93 166.2 4.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.714 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -122.44 172.21 8.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 164.61 31.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.07 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -47.16 128.82 12.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.317 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.08 21.79 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.469 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.7 m-20 -66.35 128.91 38.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.631 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -90.48 117.34 29.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.13 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.687 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.0 p90 -133.75 168.27 19.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.848 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.696 ' HB2' HG13 ' A' ' 172' ' ' VAL . 61.4 m-85 -114.71 171.03 7.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.768 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.71 123.2 30.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 10.2 mmt -83.13 168.74 16.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.971 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -59.75 -28.49 67.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.012 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -97.35 28.16 3.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.1 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.38 38.53 28.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.43 141.73 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.836 ' O ' HG13 ' A' ' 151' ' ' VAL . 0.3 OUTLIER -90.31 125.08 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.967 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.696 HG13 ' HB2' ' A' ' 164' ' ' TYR . 12.3 p -145.11 130.24 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.46 -173.44 4.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.023 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -61.08 2.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.08 -23.56 47.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.366 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.695 ' HB3' HG23 ' A' ' 172' ' ' VAL . 85.4 m-20 -89.98 -23.38 21.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.063 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.502 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.1 t80 -54.54 -66.03 0.47 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.839 0.352 . . . . 0.0 111.045 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -55.56 -26.18 42.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.119 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 72.4 m -82.02 -27.66 32.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.12 -20.69 18.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.387 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.72 -178.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.483 HG22 ' N ' ' A' ' 8' ' ' MET . 13.4 p . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.793 0.33 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.483 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -155.95 -177.95 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.595 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.2 p -155.1 131.84 2.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.276 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.51 HG23 ' CD1' ' A' ' 163' ' ' PHE . 52.9 t -55.41 146.16 4.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.464 ' C ' HG23 ' A' ' 159' ' ' THR . . . -128.09 -151.86 7.68 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.739 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -73.69 128.24 87.24 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.473 0.177 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.7 ' HB2' HG12 ' A' ' 134' ' ' VAL . 33.5 Cg_exo -55.94 151.17 42.75 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.27 1.98 . . . . 0.0 112.342 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.04 149.75 7.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.36 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.659 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.0 OUTLIER -144.07 173.49 11.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.225 -179.471 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.402 ' HE1' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -57.17 -52.94 63.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.767 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.588 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 59.18 83.24 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.457 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -167.15 -43.55 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.519 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 63.45 27.3 15.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 0.0 110.774 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.508 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 61.23 -170.19 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.839 -179.983 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.05 150.26 22.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.522 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.739 ' HB3' HD22 ' A' ' 27' ' ' LEU . 40.0 m-20 -83.91 -42.69 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.866 0.365 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.87 -29.15 68.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.29 -74.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.949 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG2' ' CG ' ' A' ' 102' ' ' PHE . 30.5 tp10 -72.92 163.44 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.958 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -76.0 99.94 4.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 22' ' ' ASP . 2.0 tp -77.38 163.25 26.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.906 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.966 HG21 HD21 ' A' ' 88' ' ' LEU . 6.7 pt -62.86 149.28 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.198 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 m -107.78 106.85 17.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.38 101.78 12.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.393 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -150.3 166.1 31.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.936 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -89.73 151.55 21.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -94.27 -178.57 4.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.855 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 34' ' ' THR . 28.8 m -133.29 35.65 3.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -97.49 -74.43 0.57 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 68.06 -69.64 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -105.7 83.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.885 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.523 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 120.701 0.286 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.76 165.38 1.17 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.493 2.129 . . . . 0.0 112.195 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 58.64 30.66 20.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.521 HD13 ' CD2' ' A' ' 69' ' ' HIS . 8.3 tt -107.95 136.24 19.77 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.995 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HD2' HG13 ' A' ' 60' ' ' ILE . 19.6 Cg_endo -61.57 125.95 17.96 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.288 1.992 . . . . 0.0 111.98 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.6 157.72 15.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.177 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.404 ' HB2' HG12 ' A' ' 70' ' ' ILE . 4.9 t -58.26 142.49 47.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.494 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . . . -62.9 114.75 3.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.27 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.72 28.53 46.55 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.997 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.43 -178.92 5.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.854 0.359 . . . . 0.0 110.944 -179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -109.19 -29.31 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.83 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -104.67 -165.67 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.847 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CD2' HD13 ' A' ' 60' ' ' ILE . 3.7 p80 -106.6 173.42 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.986 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.561 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.3 mm -92.05 153.81 3.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.196 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.561 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -165.8 31.65 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.806 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.33 -178.96 3.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.23 -36.15 11.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.002 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.547 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.3 m-85 -106.72 116.66 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.547 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.9 mm -134.41 154.02 36.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.284 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.6 mp -112.81 108.95 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.291 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.71 123.3 34.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.1 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.711 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -158.32 161.06 37.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.055 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.79 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 57.59 35.83 26.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.017 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 62.63 35.81 14.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.82 168.94 5.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 41.6 p-80 -94.21 117.95 30.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.925 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.79 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 56.2 m95 -110.08 127.23 54.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.709 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.9 175.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.116 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.05 -39.26 30.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.651 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -91.06 -34.67 15.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 9.3 m -71.43 -28.4 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.966 HD21 HG21 ' A' ' 28' ' ' ILE . 57.7 tp -74.56 81.12 1.98 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -147.3 162.35 39.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.874 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.96 147.03 48.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -29.95 60.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.134 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.57 -63.01 1.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.497 ' HB2' HG22 ' A' ' 95' ' ' VAL . 19.4 m -59.31 -32.7 70.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.032 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 56.35 23.03 6.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.151 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.497 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -88.09 147.39 40.49 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.143 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.39 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.503 2.135 . . . . 0.0 112.286 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.4 mp -108.99 65.0 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.741 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.98 30.56 3.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.165 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.666 ' C ' HD11 ' A' ' 28' ' ' ILE . 25.5 mm-40 -140.47 -49.64 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.59 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -139.21 167.37 22.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.819 179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.661 ' HB2' HG23 ' A' ' 28' ' ' ILE . 9.0 t -157.0 127.96 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.984 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.481 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.5 OUTLIER -113.07 156.17 23.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.808 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.4 p -145.33 127.39 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.966 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -149.1 123.99 9.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -92.47 1.81 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.477 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -157.78 36.08 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.805 0.336 . . . . 0.0 110.838 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -154.82 152.16 29.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.876 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.537 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.3 p -84.15 115.99 27.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -118.84 158.13 26.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.536 ' HB3' HD21 ' A' ' 97' ' ' LEU . 30.2 p -99.93 171.7 7.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.691 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.04 -32.61 51.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.347 -179.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 3.7 t0 -51.53 -58.11 7.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.43 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -73.33 -20.68 60.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.328 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.508 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 8.5 t80 -62.32 -31.53 72.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.864 0.364 . . . . 0.0 110.815 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.3 m-85 -74.22 -35.26 63.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.755 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -85.09 -55.56 3.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.148 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -71.55 -48.26 49.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.348 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 5.4 m-85 -103.27 37.07 2.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.872 0.368 . . . . 0.0 111.087 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.74 173.13 35.07 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.585 HG22 ' CG1' ' A' ' 142' ' ' VAL . 0.2 OUTLIER -59.06 155.03 14.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.717 0.294 . . . . 0.0 110.895 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.408 ' C ' HD11 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -166.15 160.14 15.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.035 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.409 ' N ' HD11 ' A' ' 129' ' ' ILE . 49.6 t -57.9 136.91 57.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.19 19.69 5.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.296 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.3 -48.29 1.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.827 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 1.8 m -111.02 -15.24 13.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.139 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 65.3 29.89 11.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.916 0.389 . . . . 0.0 110.627 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tp -82.62 136.08 34.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.765 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -55.69 99.96 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.731 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.409 HD11 ' N ' ' A' ' 122' ' ' CYS . 46.1 mt -63.37 128.55 92.65 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.476 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 88.1 Cg_exo -44.22 169.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.547 2.165 . . . . 0.0 112.691 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.07 -47.03 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.622 2.214 . . . . 0.0 113.987 -178.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.588 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.11 21.41 8.09 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.659 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.6 146.63 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.7 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -90.56 110.64 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 0.0 111.422 -179.451 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.709 HG23 ' HG ' ' A' ' 145' ' ' LEU . 9.7 p -150.2 163.36 3.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.03 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.486 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 147.14 24.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.554 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.0 129.65 56.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.78 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -64.66 96.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.599 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.484 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 56.97 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.429 0.633 . . . . 0.0 111.686 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.0 m-20 -101.99 -48.75 4.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.776 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -82.06 160.6 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.725 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.585 ' CG1' HG22 ' A' ' 120' ' ' THR . 10.4 p -106.23 153.46 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.58 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.66 173.12 11.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.125 0.488 . . . . 0.0 111.389 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -70.82 163.15 27.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.904 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.709 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -79.8 -31.04 40.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.166 0.507 . . . . 0.0 109.741 178.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.25 -49.19 6.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.815 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 71.4 m -49.9 -38.04 34.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.318 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.786 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.5 OUTLIER -56.97 112.43 1.33 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 111.046 -179.692 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.06 171.73 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.95 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.77 149.98 37.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.93 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 152' ' ' VAL . 9.9 m -75.55 -32.06 24.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.074 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -103.29 -49.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.13 -28.03 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 59.04 41.98 19.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.008 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -129.07 141.15 51.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.995 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -64.11 151.19 43.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.678 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.7 mm? -104.47 162.71 13.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.689 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.96 171.26 15.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.311 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.464 HG23 ' C ' ' A' ' 11' ' ' GLY . 4.9 m -43.98 125.32 4.27 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.609 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.14 -22.49 38.23 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.769 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.471 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.6 t0 -68.55 131.3 45.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.772 0.32 . . . . 0.0 110.778 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.44 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.5 mt-10 -87.88 128.45 35.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.008 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.884 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -145.03 140.56 28.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.127 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.687 ' HB2' HG13 ' A' ' 172' ' ' VAL . 54.1 m-85 -98.09 132.49 43.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.556 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.78 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.9 tp -87.96 111.0 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.839 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.5 mmt -74.77 148.76 40.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.901 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.72 -28.06 67.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.056 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -97.58 34.6 1.81 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 60.5 p 53.53 80.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.432 ' HD3' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -156.17 130.63 8.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.811 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.884 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.6 mp -92.5 128.77 38.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.958 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.687 HG13 ' HB2' ' A' ' 164' ' ' TYR . 6.6 p -144.99 118.84 2.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.2 p -66.56 -172.87 0.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.656 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -77.15 -39.26 49.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.355 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.11 -59.04 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.521 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -74.22 -9.33 58.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.501 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 8.6 t80 -57.05 -66.13 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -63.87 -28.59 69.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.009 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.0 m -77.77 -21.72 51.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.223 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.16 -29.85 13.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.774 0.321 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . 0.428 ' HE2' ' CE1' ' A' ' 177' ' ' TYR . 0.1 OUTLIER -170.35 -178.22 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 179.999 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.458 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 9.1 p . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.797 0.332 . . . . 0.0 111.489 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.421 ' HE3' ' HB2' ' A' ' 8' ' ' MET . 0.0 OUTLIER -131.76 -163.06 1.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 162' ' ' GLU . 9.8 p -147.58 132.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.406 ' CG2' ' CD1' ' A' ' 163' ' ' PHE . 21.6 t -55.58 146.19 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.224 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.418 ' C ' HG23 ' A' ' 159' ' ' THR . . . -124.33 -174.77 14.16 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.371 -0.919 . . . . 0.0 112.908 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 50.9 mt-10 -56.64 137.39 77.49 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.558 0.218 . . . . 0.0 110.935 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.802 ' HB2' HG12 ' A' ' 134' ' ' VAL . 14.7 Cg_exo -67.01 136.99 43.03 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.498 2.132 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.417 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.7 OUTLIER -166.07 142.97 5.22 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.113 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.959 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.6 OUTLIER -116.28 173.89 6.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 111.443 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.44 ' HE2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.36 -38.74 81.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.669 -179.223 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 71.67 55.72 7.22 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.336 -0.935 . . . . 0.0 111.975 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.04 23.24 30.28 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.804 -0.713 . . . . 0.0 113.042 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -51.07 95.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.868 0.366 . . . . 0.0 110.738 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 3.1 m-85 -57.79 -35.25 70.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.828 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.07 176.12 43.43 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.485 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.756 ' HB3' HD22 ' A' ' 27' ' ' LEU . 74.1 m-20 -83.99 -30.79 25.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.844 0.354 . . . . 0.0 110.965 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.17 -31.83 73.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.66 -76.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 32.3 mm-40 -82.78 172.19 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.023 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -76.02 118.16 18.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.756 HD22 ' HB3' ' A' ' 22' ' ' ASP . 3.4 tp -95.71 165.15 12.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.939 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.68 144.21 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.178 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.437 HG22 ' HG ' ' A' ' 31' ' ' LEU . 20.2 m -109.19 106.76 16.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -82.74 101.64 11.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.263 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.1 166.04 28.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.155 -179.563 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.03 145.45 44.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.484 ' ND2' HG21 ' A' ' 70' ' ' ILE . 1.1 t30 -95.02 -167.68 1.67 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.841 HG23 ' HB2' ' A' ' 38' ' ' ALA . 6.2 t -82.35 58.6 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.924 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 pm0 45.26 -169.41 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.569 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 71' ' ' LEU . 4.4 t80 -91.9 -22.9 19.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.013 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -57.61 -20.52 33.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.841 ' HB2' HG23 ' A' ' 34' ' ' THR . . . . . . . . 0 C--N 1.332 -0.189 0 CA-C-O 120.801 0.334 . . . . 0.0 111.479 -179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 60' ' ' ILE . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.092 0 CA-C-O 120.686 0.279 . . . . 0.0 110.86 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.35 154.61 40.99 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.526 2.15 . . . . 0.0 112.352 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 57.27 28.9 15.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.923 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.636 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -94.64 134.9 24.49 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.031 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 60' ' ' ILE . 13.3 Cg_endo -57.45 125.97 20.48 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.459 2.106 . . . . 0.0 111.981 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.01 146.8 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.148 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.9 t -57.1 155.29 8.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -80.08 114.71 19.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.565 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.38 -59.06 0.38 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.466 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.7 p -96.94 161.31 13.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -91.8 75.62 5.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -178.15 134.0 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.896 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.636 ' CD2' HG21 ' A' ' 60' ' ' ILE . 7.1 p80 -63.94 153.4 37.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.484 HG21 ' ND2' ' A' ' 33' ' ' ASN . 10.3 mm -79.24 151.26 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.401 ' O ' ' CD2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -157.35 30.61 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -102.99 -178.98 3.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -35.52 8.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.678 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -106.18 107.2 18.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.683 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 37.4 mm -128.92 153.06 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 111.485 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.1 mp -108.6 110.33 21.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.147 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -90.68 126.55 36.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.247 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.769 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.69 165.73 31.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.963 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.667 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 57.07 34.63 25.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.108 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.87 40.18 9.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.088 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -177.53 169.03 2.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.943 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.411 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 34.6 p-80 -88.8 120.97 30.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.896 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.667 ' NE1' HD12 ' A' ' 79' ' ' LEU . 55.2 m95 -111.7 128.24 56.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.85 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.46 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.83 167.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.854 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 t -73.3 -39.5 65.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.748 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -91.08 -37.42 13.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.19 -31.53 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.958 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 28' ' ' ILE . 10.9 tp -65.97 85.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -156.1 161.38 40.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.922 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 147.04 40.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.1 m -69.41 -28.82 66.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.048 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.77 -60.19 1.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.9 m -58.69 -39.12 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.034 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 57.48 22.43 8.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.442 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.4 m -85.37 154.39 59.66 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.71 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.486 2.124 . . . . 0.0 112.204 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 95' ' ' VAL . 9.3 mp -111.12 57.88 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.728 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.2 43.19 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -157.43 -62.23 0.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.686 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.99 128.97 41.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.448 ' CB ' HG23 ' A' ' 28' ' ' ILE . 11.0 t -129.89 127.91 41.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 4.2 m-85 -111.48 171.94 7.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.731 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.498 ' HB3' HD22 ' A' ' 79' ' ' LEU . 11.7 p -149.5 137.24 20.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 110.973 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -169.44 123.97 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.842 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.99 17.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.613 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 60.86 38.31 17.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.831 0.348 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -156.18 156.29 33.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.862 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.9 p -78.0 120.72 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.118 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -124.79 151.56 45.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.944 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 24.4 p -103.32 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.436 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.437 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.06 -41.01 36.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.291 -179.653 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -43.53 -58.04 2.82 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.59 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -75.58 -20.49 58.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 20' ' ' PHE . 56.0 t80 -64.32 -35.31 80.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.013 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 33.4 m-85 -67.63 -44.69 77.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.036 0.446 . . . . 0.0 110.87 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -80.49 -32.55 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.314 -179.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -80.82 -56.59 4.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.341 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.432 ' CG ' ' CE1' ' A' ' 114' ' ' PHE . 5.4 m-85 -95.48 -43.06 8.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.155 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -66.58 -150.64 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.3 m -103.18 154.05 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.68 0.276 . . . . 0.0 110.71 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . 0.445 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.0 OUTLIER -137.23 179.36 6.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 111.268 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 129' ' ' ILE . 49.8 t -78.85 141.73 37.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.079 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.15 20.3 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.438 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -49.36 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.893 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 19.9 p -111.22 -17.66 13.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 67.35 47.09 1.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.956 0.408 . . . . 0.0 111.097 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.11 -162.08 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.58 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -117.33 79.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.903 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.499 HD11 ' CA ' ' A' ' 122' ' ' CYS . 2.1 mp -59.53 139.09 89.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.525 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 73.9 Cg_exo -46.84 172.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.248 1.965 . . . . 0.0 111.989 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.418 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.3 Cg_endo -77.13 -55.02 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.305 2.003 . . . . 0.0 113.798 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.84 22.17 9.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.474 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.959 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.55 -166.85 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.521 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -122.77 111.68 31.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.967 0.413 . . . . 0.0 111.412 -179.672 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.753 HG23 ' HG ' ' A' ' 145' ' ' LEU . 14.1 p -148.74 162.72 5.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.493 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.02 137.97 34.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.897 0.38 . . . . 0.0 110.891 -179.832 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.65 173.09 6.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.748 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.669 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -142.21 134.4 27.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.931 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.876 ' CG ' HD13 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 39.65 -84.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.609 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 138' ' ' ALA . 10.7 t0 -144.33 41.08 1.35 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.815 0.34 . . . . 0.0 111.152 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.447 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . 10.8 m-85 -148.11 165.05 32.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.48 ' O ' HG13 ' A' ' 142' ' ' VAL . 14.6 p -115.51 121.11 66.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.669 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 51.0 m-85 -113.61 140.1 48.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.283 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 3.3 m80 -58.87 150.4 24.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.802 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.753 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.6 OUTLIER -61.74 -21.92 64.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.179 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.19 -49.14 6.54 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.598 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 63.9 m -57.04 -40.77 77.42 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.916 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.779 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.2 OUTLIER -56.85 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.119 -179.698 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.15 172.8 4.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.795 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.7 t -82.13 150.25 27.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.208 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 29.1 m -73.62 -31.89 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.304 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 20.5 t -99.46 -57.57 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.467 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.2 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.104 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? 60.0 44.5 13.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.95 139.63 52.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.622 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.9 mp0 -66.58 166.31 13.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.428 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.722 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.2 mm? -122.22 166.42 14.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.396 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 169.16 19.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.029 0.442 . . . . 0.0 111.472 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.434 HG23 ' N ' ' A' ' 12' ' ' GLU . 7.4 m -43.79 129.29 5.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.654 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 92.71 -21.36 39.37 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.882 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.45 ' OD1' HD12 ' A' ' 157' ' ' LEU . 6.9 t70 -73.91 130.96 40.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.835 0.35 . . . . 0.0 110.791 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.444 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 14.4 mt-10 -87.99 127.07 35.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.019 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.804 ' CD2' HD23 ' A' ' 171' ' ' LEU . 25.9 p90 -134.62 179.07 6.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.419 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.731 ' HB2' HG13 ' A' ' 172' ' ' VAL . 16.1 m-85 -133.08 115.04 14.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.333 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.876 HD13 ' CG ' ' A' ' 139' ' ' GLN . 5.9 tt -87.97 110.78 20.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 110.595 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . 0.428 ' HE2' HG11 ' A' ' 172' ' ' VAL . 18.4 mmt -75.96 164.33 26.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.24 -28.13 62.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.171 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -97.38 28.92 3.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.54 33.96 23.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.987 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -98.39 98.55 9.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.804 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.5 OUTLIER -66.97 133.11 49.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.788 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.752 HG23 ' OD2' ' A' ' 176' ' ' ASP . 2.7 p -145.18 140.26 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.0 m -71.46 -178.43 2.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.965 0.412 . . . . 0.0 111.313 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.11 -31.15 22.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.885 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.57 25.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.451 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.752 ' OD2' HG23 ' A' ' 172' ' ' VAL . 8.1 p-10 -83.0 4.15 27.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.648 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.524 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 27.9 t80 -61.77 -66.14 0.58 Allowed 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.08 0.467 . . . . 0.0 110.966 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.03 -28.78 0.74 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.826 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -31.53 57.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.367 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.1 -31.74 12.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.514 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 64.42 174.28 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.868 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 ' N ' ' A' ' 8' ' ' MET . 13.2 p . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.869 0.366 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.485 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -145.08 179.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.605 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.467 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.7 p -155.03 135.38 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.358 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.453 HG23 ' CD1' ' A' ' 163' ' ' PHE . 43.9 t -60.42 146.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.45 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.473 ' C ' HG23 ' A' ' 159' ' ' THR . . . -130.14 -160.72 10.18 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.777 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 4.5 mm-40 -64.0 132.02 95.14 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.579 0.228 . . . . 0.0 110.832 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.555 ' HB2' HG12 ' A' ' 134' ' ' VAL . 21.9 Cg_exo -63.16 143.64 90.48 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.311 2.008 . . . . 0.0 112.337 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.13 155.01 11.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.372 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.915 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.1 OUTLIER -144.09 173.88 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.138 0.494 . . . . 0.0 111.697 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -68.38 0.24 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.144 -179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 85.49 63.32 1.57 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.268 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -109.45 -70.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.543 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.4 ' CA ' ' HB3' ' A' ' 131' ' ' PRO . 4.2 tt0 72.42 84.01 0.13 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.908 0.385 . . . . 0.0 110.793 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.483 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.4 OUTLIER -57.28 -167.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.926 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -177.51 179.69 48.08 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.581 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.635 ' HB3' HD22 ' A' ' 27' ' ' LEU . 11.6 m-20 -81.32 -30.03 34.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 110.955 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -58.26 -26.26 62.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -56.99 -68.56 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.076 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 6.5 mm-40 -103.42 176.02 5.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.939 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 121.8 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -95.65 162.08 13.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.804 HD11 ' C ' ' A' ' 99' ' ' GLU . 7.4 pt -62.84 158.28 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 m -123.8 106.95 10.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.827 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.04 101.86 6.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -144.68 162.22 37.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 6.3 mp0 -81.61 156.99 24.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.892 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.464 ' ND2' HG21 ' A' ' 70' ' ' ILE . 3.4 m-20 -107.5 171.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.2 t -97.89 37.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -127.02 163.09 24.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -169.76 -42.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -142.08 80.26 1.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.965 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.139 -179.993 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.682 0.277 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.99 168.73 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.546 2.164 . . . . 0.0 112.232 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 57.88 30.25 18.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.662 HD13 ' CD2' ' A' ' 69' ' ' HIS . 8.8 tt -105.01 136.65 19.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.975 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.71 125.88 20.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.351 2.034 . . . . 0.0 111.799 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.87 134.51 38.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.262 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.433 ' HB2' HG12 ' A' ' 70' ' ' ILE . 3.2 t -59.27 141.82 53.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.774 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -63.38 114.84 4.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.132 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.91 26.37 45.57 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.025 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -128.67 -178.88 4.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.798 0.333 . . . . 0.0 110.832 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -134.99 35.61 3.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.951 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' CG ' ' CE1' ' A' ' 69' ' ' HIS . 16.2 tt0 -151.7 -88.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.662 ' CD2' HD13 ' A' ' 60' ' ' ILE . 1.5 p80 175.75 -179.18 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.758 0.313 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.464 HG21 ' ND2' ' A' ' 33' ' ' ASN . 3.2 mm -103.33 150.88 6.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.022 0.439 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.83 37.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.85 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -109.38 170.35 8.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.912 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -70.05 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.429 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -90.3 140.23 29.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.7 mm -141.56 151.24 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.16 106.96 17.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.496 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -90.83 115.48 27.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.978 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -152.71 167.03 30.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.794 HD21 ' SG ' ' A' ' 101' ' ' CYS . 1.6 mt 57.5 35.34 25.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 62.59 35.52 14.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.032 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -172.47 176.11 3.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.027 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.45 ' CD2' HG13 ' A' ' 70' ' ' ILE . 48.7 p-80 -95.43 117.95 31.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.706 ' CB ' HD13 ' A' ' 88' ' ' LEU . 61.5 m95 -110.72 125.79 53.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.731 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.93 175.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 t -80.01 -40.55 27.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.484 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -91.12 -19.71 22.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.27 17.65 9.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.306 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 83' ' ' TRP . 10.2 tp -127.93 73.59 1.47 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -127.26 150.49 49.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -60.48 126.42 27.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.799 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.4 m -58.48 -20.8 48.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.472 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -102.87 -63.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.765 0.317 . . . . 0.0 111.347 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.8 m -68.98 -30.18 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.25 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 15.0 t-160 57.87 22.35 8.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.028 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.9 m -87.23 152.21 52.45 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.177 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.93 118.97 5.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.24 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.58 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.3 mp -113.17 56.41 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.42 28.62 3.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.202 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.804 ' C ' HD11 ' A' ' 28' ' ' ILE . 3.4 mm-40 -135.09 -46.54 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.781 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.9 mtm180 -148.75 138.02 21.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.794 ' SG ' HD21 ' A' ' 79' ' ' LEU . 53.5 t -112.96 156.02 23.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.453 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -158.14 120.72 3.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.4 t -112.93 152.96 28.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.75 123.95 8.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.56 -104.99 1.32 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.443 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -67.72 0.89 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.788 0.327 . . . . 0.0 110.825 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.7 m -70.08 -176.97 1.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.534 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.5 p -110.57 116.0 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.096 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -113.86 120.9 42.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.447 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.4 p -63.98 173.99 1.66 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.847 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.453 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.06 -30.0 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 22.6 t0 -53.33 -58.01 8.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.312 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -71.93 -20.72 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.079 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.483 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 8.6 t80 -62.04 -27.22 68.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 2.3 m-85 -79.15 -44.56 21.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt -85.41 -62.39 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.466 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -58.16 -52.09 67.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.762 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 7.3 m-85 -88.46 -43.03 11.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.347 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.41 -159.9 17.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.416 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -103.09 142.92 33.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.786 0.327 . . . . 0.0 110.827 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 173.87 11.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.074 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.2 138.18 58.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.55 29.59 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.122 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.18 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.923 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 10.3 p -109.9 8.03 24.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.325 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 57.96 29.86 18.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.815 0.34 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.3 tp -87.55 143.82 27.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.787 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.65 103.69 1.24 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.698 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.608 ' CG2' HD11 ' A' ' 15' ' ' LEU . 53.8 mt -60.76 134.34 92.18 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.5 0.19 . . . . 0.0 110.489 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.515 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 80.4 Cg_exo -45.99 172.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.507 2.138 . . . . 0.0 112.54 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.4 ' HB3' ' CA ' ' A' ' 19' ' ' GLU . 7.3 Cg_exo -73.72 -55.37 0.09 OUTLIER 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.856 2.37 . . . . 0.0 113.393 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -126.14 22.05 7.31 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.617 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.915 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -53.57 -178.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.492 179.836 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.52 111.96 33.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.908 0.385 . . . . 0.0 111.123 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.713 HG23 ' HG ' ' A' ' 145' ' ' LEU . 7.1 p -157.09 164.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.952 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.505 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.59 138.18 34.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.493 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.72 130.08 52.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.785 -179.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.435 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.86 96.0 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 37.64 -88.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.1 m-20 -79.2 -34.27 43.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.789 -176.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.444 ' CD1' ' N ' ' A' ' 141' ' ' PHE . 1.3 m-85 -115.71 178.25 4.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 112.23 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 9.9 p -113.62 152.19 15.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.598 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -132.06 174.99 9.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.167 0.508 . . . . 0.0 111.561 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -81.48 166.63 20.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.014 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.713 ' HG ' HG23 ' A' ' 135' ' ' VAL . 3.6 mp -81.19 -33.42 33.01 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.32 -49.31 6.42 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.891 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 65.7 m -51.53 -35.06 38.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.201 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.642 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.92 117.97 4.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.221 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.34 -176.95 1.69 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.885 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.3 t -100.36 150.08 22.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.957 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 152' ' ' VAL . 8.4 m -69.33 -27.47 34.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 151' ' ' VAL . 21.4 t -104.99 -55.69 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.351 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.3 m -65.96 -27.92 68.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.979 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 17.9 tttt 58.04 31.94 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -123.97 144.18 49.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.015 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.525 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.0 mt-30 -61.92 162.41 9.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.322 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.4 mm? -113.99 165.22 12.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.47 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.404 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 168.75 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.489 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.473 HG23 ' C ' ' A' ' 11' ' ' GLY . 5.3 m -43.46 128.42 4.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.67 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.63 -25.35 23.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.681 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.467 ' C ' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -66.39 129.69 40.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.784 0.326 . . . . 0.0 110.758 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.45 ' HA ' HG23 ' A' ' 9' ' ' VAL . 20.9 mt-10 -87.89 124.17 33.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.877 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.1 p90 -140.18 147.72 40.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.012 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.694 ' HB2' HG13 ' A' ' 172' ' ' VAL . 36.8 m-85 -102.16 159.72 15.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.417 HD13 ' HE1' ' A' ' 8' ' ' MET . 1.1 tp -112.86 110.94 21.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.757 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 13.0 mmt -74.63 166.25 23.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.029 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -60.62 -26.96 67.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -96.95 27.93 3.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.073 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 57.46 40.02 27.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.068 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -104.03 141.54 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.877 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -93.3 130.86 38.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.694 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.1 p -145.06 123.68 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.073 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 26.4 m -56.51 -170.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.95 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -74.4 -57.68 3.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.55 82.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.073 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -65.46 -25.7 67.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.957 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . 0.456 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 9.5 t80 -54.67 -66.13 0.46 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.01 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.78 -32.83 73.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 57.7 m -67.4 -31.56 71.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -80.55 -51.96 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.104 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.35 -67.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . 0.451 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 1.6 mt-30 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.935 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.493 HG22 ' N ' ' A' ' 8' ' ' MET . 11.9 p . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.833 0.349 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.606 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -154.49 -178.17 6.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.524 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.8 p -155.05 136.29 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.004 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.448 HG21 ' HB3' ' A' ' 157' ' ' LEU . 30.1 t -52.88 146.3 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.903 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.742 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -140.86 -144.14 4.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.817 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 29.8 mt-10 -76.59 120.14 80.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.552 0.215 . . . . 0.0 110.808 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.918 ' HB2' HG12 ' A' ' 134' ' ' VAL . 20.7 Cg_exo -62.82 140.08 78.06 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.344 2.029 . . . . 0.0 112.127 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.36 164.55 34.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -138.0 173.44 11.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -29.18 68.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.809 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.14 87.31 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.619 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.33 124.3 1.18 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.569 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -107.08 22.78 15.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.709 0.29 . . . . 0.0 110.865 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 63.3 -179.9 0.15 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.38 133.04 6.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.532 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.488 ' HB3' HD22 ' A' ' 27' ' ' LEU . 65.5 m-20 -58.31 -30.53 66.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.836 0.35 . . . . 0.0 110.994 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -59.71 -28.64 67.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -58.52 -68.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.443 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 1.6 mm-40 -95.4 176.08 6.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.748 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -76.98 144.18 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.84 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.8 tp -112.01 165.14 12.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.931 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.949 HD12 HD21 ' A' ' 88' ' ' LEU . 35.5 mm -62.79 157.54 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.034 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.485 ' N ' HG22 ' A' ' 28' ' ' ILE . 3.6 m -124.75 106.95 10.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.924 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 101.88 12.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.546 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.578 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -139.71 149.62 43.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.945 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.21 145.31 37.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.493 ' O ' HG22 ' A' ' 34' ' ' THR . 2.0 m120 -108.91 -26.51 10.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.031 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 33' ' ' ASN . 15.0 t 45.31 36.0 2.09 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -113.78 34.69 4.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.825 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -59.58 -69.21 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -69.85 78.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.15 179.945 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.644 0.259 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.35 164.59 30.03 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.459 2.106 . . . . 0.0 112.187 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.88 30.63 20.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.749 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.597 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -104.76 135.3 19.32 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.067 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 14.8 Cg_endo -58.0 125.93 20.08 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.412 2.075 . . . . 0.0 112.035 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.17 138.67 31.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -57.43 164.19 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.869 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.469 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -84.29 114.61 21.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.377 179.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.16 -82.1 0.35 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.482 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.0 p -91.34 154.2 19.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 110.94 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -75.8 88.86 2.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -178.53 135.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.597 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.1 p80 -72.23 145.28 48.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.01 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.461 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -72.27 153.35 7.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.16 36.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -112.07 138.14 49.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.815 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -34.06 63.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.192 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -106.55 107.71 18.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.052 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.422 HG22 ' N ' ' A' ' 76' ' ' LEU . 47.9 mm -123.5 153.44 29.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.078 0.466 . . . . 0.0 111.258 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.422 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.0 mp -115.15 106.94 14.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.167 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 46.0 tttt -90.66 123.11 34.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.026 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.19 167.04 31.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.066 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.748 HD23 ' HD2' ' A' ' 26' ' ' ARG . 1.7 mt 57.29 34.12 24.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.125 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.84 34.3 14.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.79 171.98 5.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.058 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -89.72 117.94 28.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.852 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.71 ' NE1' HD12 ' A' ' 79' ' ' LEU . 47.4 m95 -111.44 126.08 54.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.848 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.461 ' CD2' HD11 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -52.53 143.66 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.931 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.3 p -57.59 -37.58 73.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -91.08 -12.77 34.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.261 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 61.5 m -104.95 22.44 15.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.687 0.28 . . . . 0.0 111.152 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.949 HD21 HD12 ' A' ' 28' ' ' ILE . 18.2 tp -118.88 30.63 7.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.859 0.362 . . . . 0.0 110.864 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.6 153.27 20.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.871 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 5.4 t -59.33 147.02 37.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.74 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.77 -28.43 66.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.294 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -105.03 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 0.0 111.253 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.576 ' HB2' HG22 ' A' ' 95' ' ' VAL . 20.2 m -58.82 -29.44 66.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.166 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 57.77 21.8 7.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.134 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.576 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.8 m -90.46 156.61 45.44 Favored Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.166 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 118.94 5.77 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.443 2.095 . . . . 0.0 112.245 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.766 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.3 mp -101.29 72.27 1.42 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.5 30.6 3.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.084 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -146.6 -47.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.676 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.3 158.35 44.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.776 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.575 ' HB3' HD11 ' A' ' 28' ' ' ILE . 26.7 p -141.85 175.95 9.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.034 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' CE2' ' A' ' 114' ' ' PHE . 1.1 t80 -162.72 152.14 15.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.773 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -134.22 135.04 42.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HG3' ' CZ ' ' A' ' 118' ' ' PHE . 28.5 mmt-85 -147.95 124.0 10.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.31 1.6 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -166.29 -44.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 110.872 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.05 179.84 1.41 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.929 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.4 p -108.25 123.0 63.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.008 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.42 169.53 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.866 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . 0.766 ' HB3' HD21 ' A' ' 97' ' ' LEU . 21.0 p -121.85 168.21 12.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.634 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 8.6 mttp -78.14 -26.75 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -54.58 -49.77 69.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.265 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -83.94 -20.53 32.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 20' ' ' PHE . 9.0 t80 -61.41 -30.5 70.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.977 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.446 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.1 m-85 -69.19 -45.94 68.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.758 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -85.44 -60.77 1.93 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.594 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.27 -52.83 63.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.168 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 5.0 m-85 -84.29 -43.06 15.19 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -64.3 -136.96 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.514 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.5 m -103.06 153.97 19.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.732 0.301 . . . . 0.0 110.789 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.76 162.27 41.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.266 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.3 t -57.47 139.33 53.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.978 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.73 29.46 2.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.17 -58.15 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 15.1 p -107.67 10.37 29.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.358 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.22 36.24 27.12 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.783 0.325 . . . . 0.0 110.973 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 15.3 tp -99.73 137.4 38.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.939 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.99 131.74 36.52 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.658 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.7 HG22 HD11 ' A' ' 15' ' ' LEU . 12.0 mt -95.09 128.22 39.74 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.395 0.141 . . . . 0.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.628 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 82.4 Cg_exo -42.73 168.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.615 2.21 . . . . 0.0 112.614 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.419 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 23.2 Cg_exo -65.46 -55.36 0.46 Allowed 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.75 2.3 . . . . 0.0 113.843 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.859 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.52 21.49 7.8 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.664 HE21 HG23 ' A' ' 129' ' ' ILE . 1.1 pp0? -61.07 136.94 58.23 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.376 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.918 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -71.91 108.73 3.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.009 0.433 . . . . 0.0 111.054 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.0 p -144.83 159.33 14.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.906 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.489 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.79 136.22 37.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.03 164.31 12.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.033 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.642 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -106.41 96.71 6.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.667 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.438 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.92 -86.24 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.361 0.6 . . . . 0.0 111.746 -179.789 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.97 -49.18 4.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.789 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -84.25 161.26 20.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.597 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.2 p -103.89 152.21 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.553 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -128.54 175.13 8.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.129 0.49 . . . . 0.0 111.654 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.82 163.4 21.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.041 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -81.23 -31.71 33.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.734 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -49.28 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.789 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . 0.419 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 78.4 m -52.48 -32.35 39.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.991 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.718 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -57.05 119.82 6.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.034 -179.822 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.27 -177.04 1.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.975 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.9 t -101.47 150.09 23.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.03 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 152' ' ' VAL . 24.6 m -68.81 -26.87 33.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.335 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 151' ' ' VAL . 27.3 t -107.03 -56.41 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.25 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.1 m -65.88 -28.13 68.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.101 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.11 34.9 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -126.42 142.34 51.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.969 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.412 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.38 152.79 16.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.262 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.699 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.3 mm? -109.5 107.96 18.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . 0.424 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -91.3 168.06 11.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.475 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . 0.742 HG23 ' HA2' ' A' ' 11' ' ' GLY . 6.9 m -40.73 132.33 2.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.83 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.07 -26.99 16.32 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.618 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.524 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.1 t0 -67.8 128.92 38.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.331 . . . . 0.0 110.84 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.473 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.3 mt-10 -87.99 114.5 24.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.825 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.805 ' CD2' HD23 ' A' ' 171' ' ' LEU . 11.5 p90 -128.16 143.62 51.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.015 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.517 ' HB2' HG13 ' A' ' 172' ' ' VAL . 11.1 m-85 -100.13 162.43 12.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.748 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.642 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -115.04 110.85 20.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.742 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.8 mmt -75.4 164.47 26.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.015 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -59.16 -26.26 64.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.129 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.71 27.09 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.099 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.0 46.76 18.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.922 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 0.1 OUTLIER -110.88 146.54 36.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.805 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -98.31 128.89 44.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.6 p -145.07 130.18 13.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 55.5 m -53.0 -179.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.108 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.413 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 0.5 OUTLIER -67.95 -61.03 2.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.32 72.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -63.58 -26.96 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.002 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -55.07 -66.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.007 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -53.99 -26.74 27.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.23 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.1 m -78.48 -30.16 47.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.976 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -93.74 -27.25 16.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.233 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm 63.28 173.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.885 -179.981 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.553 HG23 ' CE1' ' A' ' 164' ' ' TYR . 14.0 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.863 0.363 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.487 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.75 -175.09 3.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.636 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.401 HG23 ' HA ' ' A' ' 162' ' ' GLU . 4.2 p -154.39 150.8 11.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.156 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 161' ' ' ASP . 38.4 t -67.39 146.25 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.706 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.66 -162.03 10.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.388 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -71.5 145.37 90.14 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.568 0.223 . . . . 0.0 110.63 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.5 Cg_endo -83.02 130.0 5.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.58 163.73 37.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.395 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.564 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.7 OUTLIER -144.08 173.78 11.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.173 0.511 . . . . 0.0 111.621 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.534 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -38.27 87.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.428 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.745 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 64.24 81.54 0.11 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.65 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.72 -140.8 5.56 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.248 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 179.68 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.405 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 63.11 144.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.933 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 -160.45 8.9 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.534 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -83.98 -25.32 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.694 0.283 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -54.09 -26.64 28.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.245 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.43 -75.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.059 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 18.6 tp10 -101.79 163.5 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.867 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ptp85 -75.9 100.01 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.594 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.1 tp -63.33 165.21 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.808 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.0 pt -62.87 138.58 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.14 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.431 HG22 ' HG ' ' A' ' 31' ' ' LEU . 48.5 m -105.86 106.93 17.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HE ' HD11 ' A' ' 76' ' ' LEU . 1.1 tpt180 -78.34 101.69 7.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.394 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HG ' HG22 ' A' ' 29' ' ' THR . 0.3 OUTLIER -145.73 164.92 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.007 -179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.451 ' CG ' ' CE1' ' A' ' 74' ' ' PHE . 19.6 mt-10 -90.26 157.02 17.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -109.73 -29.41 8.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 34' ' ' THR . 22.5 m 62.18 31.41 17.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -115.86 71.71 0.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -105.39 31.29 5.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -158.53 79.78 0.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.927 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.733 0.302 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -51.71 165.82 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.463 2.109 . . . . 0.0 112.247 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.65 30.8 20.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.81 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.549 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -108.91 134.92 20.2 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.442 ' HD2' HD12 ' A' ' 60' ' ' ILE . 26.2 Cg_endo -63.06 125.92 16.87 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.347 2.031 . . . . 0.0 112.163 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.75 147.36 26.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.2 t -59.01 154.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.905 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.501 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.86 114.81 21.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.575 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.7 -53.37 0.62 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.43 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 19.3 p -103.61 -178.99 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.767 0.318 . . . . 0.0 110.876 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.03 76.56 1.01 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.76 131.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.549 ' CD2' HG21 ' A' ' 60' ' ' ILE . 9.7 p80 -63.97 148.14 50.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.446 HG13 ' CD2' ' A' ' 82' ' ' HIS . 5.7 mm -77.08 153.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.01 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.406 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -172.64 35.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.832 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -104.88 179.11 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.86 -68.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.451 ' CE1' ' CG ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -80.99 115.96 20.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.441 HG22 ' N ' ' A' ' 76' ' ' LEU . 44.9 mm -123.2 154.93 29.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.301 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.441 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.59 107.59 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.264 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -90.77 122.44 33.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.063 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.78 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.88 158.29 30.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.173 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.63 HD22 ' OG ' ' A' ' 103' ' ' SER . 0.6 OUTLIER 58.19 37.46 26.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.157 179.862 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 61.67 35.71 16.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.074 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -174.39 169.98 3.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.863 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.446 ' CD2' HG13 ' A' ' 70' ' ' ILE . 20.6 p-80 -89.33 125.31 35.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.961 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.658 ' CB ' HD13 ' A' ' 88' ' ' LEU . 58.6 m95 -113.65 125.36 54.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 171.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.063 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.05 -39.83 28.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -90.97 -28.26 18.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.988 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 79.1 m -71.96 -28.96 63.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.049 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.685 HD21 HG21 ' A' ' 28' ' ' ILE . 11.2 tp -79.59 82.83 5.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -137.63 150.59 47.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.4 t -64.25 130.06 42.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.789 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -23.49 52.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.491 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.13 -63.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.787 0.327 . . . . 0.0 111.226 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.449 ' HB2' HG22 ' A' ' 95' ' ' VAL . 34.0 m -66.54 -33.07 74.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.172 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.08 22.63 7.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.051 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.499 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.9 m -87.85 152.15 50.81 Favored Pre-proline 0 N--CA 1.453 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.227 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -57.24 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.504 2.136 . . . . 0.0 112.169 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.645 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.2 mp -108.86 64.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.746 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.97 29.42 3.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.808 ' C ' HD11 ' A' ' 28' ' ' ILE . 23.0 mm-40 -135.11 -46.51 0.71 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.594 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.05 173.48 11.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.692 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.5 t -156.94 156.04 32.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.017 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PHE . . . . . 0.472 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -155.96 136.09 12.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.746 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 2.0 p -151.03 174.12 13.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.009 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -177.2 123.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.29 -95.55 1.86 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.535 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -142.19 38.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.906 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' SER . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 0.7 OUTLIER -152.65 177.96 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.538 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.3 p -149.13 115.99 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.187 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 107' ' ' SER . 0.4 OUTLIER -122.15 159.89 26.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.2 p -71.53 160.22 33.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.656 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 ttmt -56.94 -45.12 82.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.074 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.438 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 30.1 t70 -58.91 -29.5 67.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.107 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -84.1 -26.07 29.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.318 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 36.7 t80 -66.8 -39.06 87.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 112' ' ' ASP . 7.5 m-85 -65.38 -39.51 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.1 tttp -84.13 -30.12 26.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.119 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.9 mmm-85 -82.09 -53.79 5.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.192 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.25 -42.99 11.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.5 167.7 53.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.419 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 33.0 m -58.5 150.27 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.756 0.312 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -145.49 163.31 35.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.051 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HB2' HD11 ' A' ' 129' ' ' ILE . 48.6 t -72.8 130.7 41.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.88 28.01 4.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.106 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -54.62 1.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 26.8 p -111.08 -22.61 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 69.67 69.81 0.24 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.11 -166.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.792 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -103.5 86.95 0.55 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.557 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.752 HG23 HE21 ' A' ' 133' ' ' GLN . 16.3 mt -65.94 126.28 91.53 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.455 0.169 . . . . 0.0 110.833 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.592 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.4 Cg_exo -51.49 -178.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.233 1.955 . . . . 0.0 111.959 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 64.9 Cg_endo -77.24 -53.25 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.298 1.998 . . . . 0.0 113.901 -179.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.745 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.94 21.83 9.77 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLN . . . . . 0.785 ' OE1' HD11 ' A' ' 145' ' ' LEU . 1.0 OUTLIER -55.49 145.33 23.14 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.365 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.898 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -87.79 108.9 18.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.963 0.411 . . . . 0.0 110.862 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' VAL . . . . . 0.69 HG23 ' HG ' ' A' ' 145' ' ' LEU . 11.4 p -150.5 159.82 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.078 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ARG . . . . . 0.507 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 137.55 35.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.83 130.67 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.975 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -70.71 96.65 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.748 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.449 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 55.31 -86.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.386 0.612 . . . . 0.0 111.797 -179.773 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.414 ' OD2' ' CZ ' ' A' ' 141' ' ' PHE . 5.5 p-10 -99.6 -47.56 5.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.723 -178.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.676 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.5 m-85 -79.26 163.24 25.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.95 133.05 61.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' TYR . . . . . 0.628 ' O ' HG21 ' A' ' 135' ' ' VAL . 5.0 m-85 -111.06 171.45 7.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.05 0.452 . . . . 0.0 111.344 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 41.1 m80 -99.52 140.01 34.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.844 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.898 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.73 -20.07 45.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.01 -36.49 14.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.266 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 14.27 32.39 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.871 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 42.5 t80 -104.05 102.31 12.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.71 0.29 . . . . 0.0 110.657 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -156.86 -176.92 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.26 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -92.23 150.04 21.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 152' ' ' VAL . 16.8 m -65.59 -26.7 39.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.315 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -104.43 -56.28 5.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.345 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 20.3 m -65.91 -28.12 68.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.074 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 30.0 7.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.13 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -119.14 153.05 35.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . 0.424 ' C ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -68.24 154.08 42.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -115.9 137.46 52.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -109.34 161.28 15.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.039 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.7 t -46.23 130.28 10.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.372 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 109.34 -34.36 5.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.591 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' ' 10' ' ' VAL . 2.2 t0 -65.17 130.29 42.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.722 0.296 . . . . 0.0 110.784 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 48.8 mt-10 -87.96 119.65 28.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' PHE . . . . . 0.547 ' CD2' HD23 ' A' ' 171' ' ' LEU . 5.7 p90 -134.01 147.57 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' TYR . . . . . 0.553 ' CE1' HG23 ' A' ' 7' ' ' VAL . 30.9 m-85 -100.59 147.3 26.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.673 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' LEU . . . . . 0.547 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -105.41 114.19 28.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.5 mmt -69.39 174.49 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -66.81 -29.08 68.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.028 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -97.74 29.8 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.028 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.86 33.95 23.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.949 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' ARG . . . . . 0.503 ' HG2' HG11 ' A' ' 151' ' ' VAL . 1.4 tpt180 -88.57 132.73 34.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' LEU . . . . . 0.871 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -84.94 121.01 27.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' VAL . . . . . 0.539 HG23 ' HB3' ' A' ' 176' ' ' ASP . 14.6 p -145.02 121.56 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.124 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 56.1 m -54.88 -174.37 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.856 0.36 . . . . 0.0 111.084 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -69.44 -60.94 2.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.15 -38.96 84.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.021 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . 0.539 ' HB3' HG23 ' A' ' 172' ' ' VAL . 13.1 m-20 -59.25 -24.77 63.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -54.77 -63.72 1.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -49.18 -27.9 3.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.304 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 -25.33 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.95 -20.55 20.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.518 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.48 -177.58 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.836 0.351 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.736 0.303 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.2 t -104.45 84.52 2.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.928 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -106.31 113.79 27.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.2 m -60.1 150.16 71.77 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.097 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -167.77 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.467 2.111 . . . . 0.0 112.328 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -64.8 80.15 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.895 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.49 HG22 ' N ' ' A' ' 8' ' ' MET . 13.5 p -124.2 158.75 30.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.154 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.49 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.74 -179.96 6.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.682 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.5 p -155.06 137.0 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.115 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.413 HG21 ' CB ' ' A' ' 157' ' ' LEU . 48.1 t -57.88 146.14 8.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.565 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.681 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -133.62 -151.11 6.44 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.782 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -71.8 122.57 87.6 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.446 0.165 . . . . 0.0 110.954 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.0 Cg_exo -64.44 142.92 80.62 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.328 2.019 . . . . 0.0 112.149 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.04 158.43 14.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.72 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.851 HD11 HG22 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -129.2 173.31 10.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.155 0.502 . . . . 0.0 111.267 -179.759 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -37.84 81.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.932 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.754 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.01 79.62 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.552 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -145.55 -55.35 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 64.19 29.48 13.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.729 0.299 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.499 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 58.93 -168.93 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.973 179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -148.99 125.3 2.0 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.443 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -59.9 -31.53 69.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.842 0.353 . . . . 0.0 110.993 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -66.51 -30.23 70.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.95 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -59.46 -74.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 5.7 tp10 -78.2 151.35 33.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.977 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -76.08 101.96 5.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.875 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 100' ' ' ARG . 1.7 tp -73.92 165.13 25.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.88 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.784 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 6.0 pt -62.86 137.61 24.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.2 m -104.34 106.89 17.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' HD2' HD12 ' A' ' 28' ' ' ILE . 0.0 OUTLIER -83.1 101.77 11.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.469 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.576 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.4 157.31 44.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.001 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -77.08 116.88 18.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.6 163.71 23.07 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.914 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.5 t -107.4 31.57 5.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -104.1 37.63 2.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -98.69 31.49 2.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.911 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -167.31 33.39 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.844 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -129.37 137.53 51.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.145 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 59.95 -179.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.163 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -88.1 79.61 7.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.892 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.3 -63.05 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.514 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.5 140.4 11.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.65 146.42 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.855 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.8 t70 60.55 158.33 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.886 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -100.79 85.21 2.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.875 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -163.43 -169.35 26.77 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.492 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.86 99.43 0.66 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.494 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 t 60.59 110.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.821 0.343 . . . . 0.0 110.858 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.5 -46.62 1.22 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 100.9 -103.0 2.52 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.553 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -96.59 114.35 25.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.815 0.34 . . . . 0.0 110.918 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 6.4 mtp -106.07 -178.66 3.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.97 117.84 1.23 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.505 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 m -158.82 102.19 1.66 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.854 0.359 . . . . 0.0 110.93 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -98.67 -142.01 12.88 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.439 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -60.03 148.64 42.7 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.459 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.0 84.95 58.97 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.684 0.278 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.74 167.15 23.8 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.468 2.112 . . . . 0.0 112.211 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 57.9 30.01 18.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.762 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.488 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -104.5 135.38 19.33 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.046 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.69 125.89 18.4 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.412 2.074 . . . . 0.0 112.069 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.404 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -92.48 148.76 21.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.109 -179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.3 t -58.36 138.11 56.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.735 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -61.6 114.85 3.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.269 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.92 28.29 42.5 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.069 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.12 -178.92 5.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 0.0 110.883 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -106.73 -28.93 9.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.76 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -166.54 1.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.821 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.488 ' CD2' HG21 ' A' ' 60' ' ' ILE . 5.1 p80 -107.53 161.51 14.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.02 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 70' ' ' ILE . 6.9 mm -74.83 153.66 6.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.053 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -163.46 30.84 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -107.2 -178.99 3.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -84.46 -74.33 0.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -75.74 125.59 29.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.997 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.421 ' C ' HD12 ' A' ' 76' ' ' LEU . 46.6 mm -134.27 148.2 29.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.123 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.3 mp -105.38 106.97 17.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.465 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -90.93 114.98 27.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.784 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -148.94 163.47 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.115 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.739 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.3 OUTLIER 55.45 35.59 25.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.07 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 62.36 40.75 10.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.068 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -176.99 166.5 2.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.013 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -88.88 117.97 28.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.888 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.739 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 65.1 m95 -111.77 126.0 54.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.844 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.434 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -51.57 175.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.171 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -80.03 -40.69 27.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.283 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.6 tttm -91.08 -16.48 27.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.128 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 7.0 m -96.4 26.1 4.58 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.022 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.597 HD21 HG21 ' A' ' 28' ' ' ILE . 1.7 tp -128.62 29.24 5.3 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.996 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.38 150.26 21.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.911 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 4.3 t -60.46 125.25 22.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.816 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.29 -22.51 61.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.289 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -99.69 -63.08 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.735 0.302 . . . . 0.0 111.206 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.511 ' HB2' HG22 ' A' ' 95' ' ' VAL . 32.0 m -66.76 -32.31 73.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 59.07 23.35 11.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.102 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.511 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.1 m -90.82 149.34 40.17 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.153 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -55.82 118.95 5.8 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.561 2.174 . . . . 0.0 112.248 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.547 HD21 ' HB3' ' A' ' 110' ' ' CYS . 7.9 mp -111.04 63.05 0.61 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.733 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.78 39.49 1.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.188 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.754 ' C ' HD11 ' A' ' 28' ' ' ILE . 9.4 mt-10 -148.25 -49.18 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.587 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -136.52 174.2 10.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.628 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.8 t -156.98 156.15 32.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.504 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.7 OUTLIER -150.13 154.63 38.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.843 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 60.1 p -132.29 144.76 50.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.993 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.64 139.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.6 40.11 95.96 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.569 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 59.6 31.22 20.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.863 0.363 . . . . 0.0 110.973 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 6.7 m -148.99 145.15 27.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.903 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.538 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.1 p -87.22 115.97 28.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.127 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.68 170.52 8.71 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.826 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.547 ' HB3' HD21 ' A' ' 97' ' ' LEU . 29.5 p -99.56 169.04 9.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.83 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 4.5 tttp -78.13 -29.79 49.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.267 -179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -53.42 -58.02 8.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.469 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 38.5 p30 -74.16 -20.94 60.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.314 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 13.5 t80 -63.65 -30.95 71.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.75 0.31 . . . . 0.0 110.926 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 5.1 m-85 -79.12 -39.21 34.21 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.089 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -85.07 -64.04 1.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.335 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -64.79 -48.62 73.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.64 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -102.01 36.89 1.98 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.332 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.94 -146.61 4.44 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.516 -0.85 . . . . 0.0 112.594 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.0 m -94.79 152.35 18.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 110.977 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.419 ' HZ3' ' HA ' ' A' ' 123' ' ' ALA . 0.0 OUTLIER -164.45 170.37 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.5 t -64.11 141.34 58.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.419 ' HA ' ' HZ3' ' A' ' 121' ' ' LYS . . . -94.74 27.14 3.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.121 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.24 -58.08 1.46 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.9 p -108.27 5.4 25.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.414 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 59.38 29.47 19.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.745 0.307 . . . . 0.0 111.14 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 20.5 tp -82.85 151.95 25.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.742 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -81.13 107.79 2.75 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.698 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.851 HG22 HD11 ' A' ' 15' ' ' LEU . 12.1 mt -70.41 130.92 88.7 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 110.52 -0.178 . . . . 0.0 110.52 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.643 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.5 Cg_exo -47.52 175.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.361 2.041 . . . . 0.0 112.23 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.7 Cg_endo -77.2 -49.91 0.1 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.471 2.114 . . . . 0.0 113.799 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.754 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.6 OUTLIER -126.06 21.7 7.41 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.34 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.643 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.8 OUTLIER -57.0 -168.73 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.68 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.777 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -123.59 108.9 21.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.936 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.697 ' HB ' HD11 ' A' ' 145' ' ' LEU . 12.4 p -152.67 158.87 3.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.065 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.481 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.86 135.92 38.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.793 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -104.93 135.0 47.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.975 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.619 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.31 96.57 2.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.939 0.399 . . . . 0.0 110.618 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.51 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.75 -86.33 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.864 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.4 -48.19 4.88 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.873 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -83.95 162.58 20.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.715 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 8.3 p -105.3 150.9 7.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.593 ' O ' HG21 ' A' ' 135' ' ' VAL . 23.0 m-85 -133.26 175.08 9.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.048 0.452 . . . . 0.0 111.37 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.31 161.84 22.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.046 -179.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.777 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.6 mp -81.08 -30.2 34.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.149 0.5 . . . . 0.0 109.678 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -91.2 -49.26 6.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.665 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.7 m -53.87 -31.26 49.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.9 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.764 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.91 121.1 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.091 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.24 -177.01 1.73 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.911 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -100.92 150.14 23.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 152' ' ' VAL . 16.7 m -64.73 -26.87 41.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.263 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.722 HG23 HG23 ' A' ' 151' ' ' VAL . 21.2 t -109.53 -55.9 4.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.338 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.6 m -65.86 -28.11 68.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.012 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 56.13 30.87 17.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.986 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -119.02 139.97 50.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.951 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.447 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.11 154.29 13.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.26 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.731 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.7 OUTLIER -116.57 107.32 14.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.538 179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -90.17 172.28 8.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.681 HG23 ' HA2' ' A' ' 11' ' ' GLY . 7.9 m -43.01 132.29 4.04 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.734 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.35 -27.86 13.97 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.664 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.591 ' OD2' HD12 ' A' ' 157' ' ' LEU . 5.4 t0 -67.0 128.84 37.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.802 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.452 ' HA ' HG23 ' A' ' 9' ' ' VAL . 9.2 mt-10 -88.04 122.21 31.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.709 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -138.45 146.75 42.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.001 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.691 ' HB2' HG13 ' A' ' 172' ' ' VAL . 48.1 m-85 -101.58 151.47 21.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.619 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -107.65 110.96 22.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.797 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.5 mtp -69.4 161.23 29.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -62.7 -28.57 70.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.074 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -97.76 29.11 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.019 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.14 83.66 0.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.978 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.422 ' HE ' HG11 ' A' ' 151' ' ' VAL . 8.1 mtp180 -154.92 131.66 10.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.764 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 4.4 mp -83.62 128.21 34.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.691 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.4 p -145.11 122.45 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.082 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 20.4 m -58.38 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.412 ' HZ1' ' CD ' ' A' ' 162' ' ' GLU . 21.6 mttt -75.52 -57.05 4.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.84 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -33.6 70.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.108 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -72.98 -28.91 62.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -56.84 -66.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.946 0.403 . . . . 0.0 110.915 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -57.31 -49.73 75.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.942 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 67.5 m -59.43 -26.3 65.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.964 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -79.08 -51.98 8.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.252 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -146.74 -66.57 0.28 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.098 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.203 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.798 0.332 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -87.86 156.46 19.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -62.15 110.22 1.54 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.856 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.788 HG21 HG12 ' A' ' 7' ' ' VAL . 15.4 m -148.2 149.0 31.07 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.098 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.94 -45.8 0.88 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.529 2.153 . . . . 0.0 112.346 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -170.07 90.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.788 HG12 HG21 ' A' ' 4' ' ' VAL . 12.6 p -117.61 158.57 18.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.152 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.484 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -139.45 -173.64 3.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.595 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 3.3 p -151.82 147.69 15.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 161' ' ' ASP . 43.9 t -66.95 146.23 13.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.628 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.32 -157.9 9.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.572 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.45 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 0.0 OUTLIER -76.31 151.29 83.35 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.665 0.269 . . . . 0.0 110.815 -179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.777 ' HB2' HG12 ' A' ' 134' ' ' VAL . 2.6 Cg_endo -83.0 143.47 11.54 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.874 2.383 . . . . 0.0 112.417 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -163.57 142.92 8.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.344 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.559 HD21 ' CG1' ' A' ' 135' ' ' VAL . 7.7 mt -127.04 173.54 9.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 111.293 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.408 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -49.51 -50.49 41.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.793 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.583 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 62.69 80.82 0.1 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.457 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -160.27 -48.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.368 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 59.56 46.33 12.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 110.923 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE1' ' CD1' ' A' ' 115' ' ' PHE . 14.0 p90 -59.17 -179.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.929 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -173.54 -132.41 1.53 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.567 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.706 ' CB ' HD13 ' A' ' 27' ' ' LEU . 4.3 p-10 -55.21 -28.42 52.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.736 0.303 . . . . 0.0 111.16 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.35 -25.99 60.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.201 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.89 -70.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.073 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.3 tp10 -101.62 175.11 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.934 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 100.68 4.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.87 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 22' ' ' ASP . 2.9 tp -63.15 165.11 7.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.95 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.763 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.3 pt -62.9 148.49 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.5 m -107.74 106.78 17.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.82 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.19 101.82 9.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.435 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.86 154.02 40.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -78.63 157.05 28.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.903 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -110.6 102.31 10.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 41.3 p -60.18 86.92 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.927 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -150.32 -76.64 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 57.68 28.58 16.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.025 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -176.67 78.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.902 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -132.28 42.34 3.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.093 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 63.19 124.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.143 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.83 35.78 19.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.884 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -95.8 -83.54 1.65 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.479 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.497 HG23 ' N ' ' A' ' 43' ' ' ASP . 4.7 tp -52.34 -44.97 44.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.834 0.35 . . . . 0.0 111.515 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.497 ' N ' HG23 ' A' ' 42' ' ' ILE . 64.7 m-20 -107.73 142.5 37.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -83.41 164.65 19.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.902 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -71.67 151.4 43.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -161.35 93.44 0.12 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.491 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.37 -38.16 3.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.528 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 m -174.59 -41.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.951 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.15 -36.51 1.91 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.469 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -81.35 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.492 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -170.35 35.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.807 0.337 . . . . 0.0 110.883 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.3 mtt -96.02 161.05 14.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.889 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.66 160.55 8.95 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.5 p -69.02 -74.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.859 0.361 . . . . 0.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.13 42.29 0.26 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.47 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 71.31 -160.65 54.09 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.572 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.581 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER -87.49 140.9 31.98 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 120.617 0.246 . . . . 0.0 110.88 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 57' ' ' THR . 63.1 Cg_endo -73.43 163.96 36.34 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.49 2.127 . . . . 0.0 112.226 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 56.98 29.07 15.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.864 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.723 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -99.1 134.89 21.02 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.077 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.2 Cg_endo -58.46 125.96 19.95 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.458 2.105 . . . . 0.0 112.097 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.19 140.12 29.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.057 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.3 p -58.36 164.22 2.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.93 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.437 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.98 114.59 24.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.445 179.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 125.09 -66.46 0.54 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.56 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -109.83 155.34 21.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.858 0.361 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -75.39 87.53 2.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.143 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.47 134.44 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.723 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.5 p80 -72.77 141.05 48.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.956 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.6 mm -67.52 153.65 8.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -172.55 35.32 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.864 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -111.82 145.83 38.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -62.25 1.77 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.179 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.0 110.84 18.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.853 0.359 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 76' ' ' LEU . 42.0 mm -121.67 153.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.211 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 75' ' ' ILE . 7.8 mp -109.61 106.75 16.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.305 179.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -91.03 116.36 28.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.964 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.763 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -157.13 165.63 35.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.163 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.805 HD12 ' NE1' ' A' ' 83' ' ' TRP . 3.0 mt 59.09 36.43 24.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.072 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 62.3 34.42 15.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.023 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -176.45 178.57 1.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.917 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.406 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 22.1 p-80 -94.41 126.85 39.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.913 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.805 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.7 m95 -116.86 132.73 56.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.771 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.08 171.55 0.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.07 -40.21 28.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.089 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.2 pttp -90.95 -28.18 18.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.127 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.405 ' HB2' ' CB ' ' A' ' 84' ' ' HIS . 57.7 m -67.6 -30.62 70.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.941 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.644 HD13 ' CB ' ' A' ' 83' ' ' TRP . 1.6 tp -81.12 94.12 6.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.979 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -155.35 154.53 32.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.933 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.65 147.03 38.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.7 t -72.78 -31.27 64.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.916 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -97.28 -59.97 1.68 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.977 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 45.7 m -60.02 -34.47 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.957 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 57.37 22.46 7.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.056 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.6 m -84.63 156.65 61.74 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.048 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.9 118.9 5.94 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.522 2.148 . . . . 0.0 112.246 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.583 HD23 ' SG ' ' A' ' 101' ' ' CYS . 7.4 mp -103.24 71.03 1.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.833 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -106.07 30.91 5.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -148.55 -49.28 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.889 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.617 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -142.99 128.99 19.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.89 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.583 ' SG ' HD23 ' A' ' 97' ' ' LEU . 1.5 t -123.83 171.09 9.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.946 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.539 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.6 m-85 -156.32 151.5 26.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.872 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.518 ' OG ' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -151.65 140.05 20.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.9 mmt-85 -150.01 123.97 9.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.887 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.23 -88.64 1.59 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.506 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.02 35.86 0.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.824 0.345 . . . . 0.0 110.929 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.447 ' HB2' ' CE1' ' A' ' 109' ' ' TYR . 48.9 m -150.73 -175.02 4.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.899 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 102' ' ' PHE . 11.7 p -136.97 116.0 15.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.082 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.447 ' CE1' ' HB2' ' A' ' 107' ' ' SER . 1.3 m-85 -116.69 173.24 6.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.9 p -89.13 178.31 6.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.844 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 12.3 ttmt -73.65 -48.97 28.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.91 -30.55 15.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.218 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -84.04 -21.64 31.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.319 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 12.9 t80 -69.52 -41.17 76.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 6.6 m-85 -66.78 -36.8 83.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.921 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.36 -44.4 13.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.25 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -78.94 -50.92 10.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.244 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -108.67 37.02 2.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.59 165.25 33.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.444 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.795 HG22 HG11 ' A' ' 142' ' ' VAL . 1.6 m -57.85 151.08 18.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.757 0.313 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -163.3 159.43 22.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.167 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 124' ' ' ALA . 43.3 t -74.2 135.76 42.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.787 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.66 34.21 1.9 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 122' ' ' CYS . . . -125.12 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.096 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 7.5 p -109.9 12.54 23.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.411 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.7 mp0 55.5 30.84 15.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.754 0.311 . . . . 0.0 111.04 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.9 tp -103.49 130.49 50.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.96 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.98 131.19 51.93 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.444 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.585 HG23 ' HD2' ' A' ' 130' ' ' PRO . 51.9 mt -79.25 140.06 56.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.922 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.589 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 92.7 Cg_exo -44.83 171.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.833 2.355 . . . . 0.0 112.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -77.37 -55.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.588 2.192 . . . . 0.0 114.807 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.583 HG23 ' CA ' ' A' ' 17' ' ' GLY . 1.6 m -126.55 21.46 7.13 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 -177.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.589 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 82.9 mm-40 -61.42 -176.04 0.07 Allowed 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.777 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.65 116.49 49.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.973 0.416 . . . . 0.0 111.167 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.559 ' CG1' HD21 ' A' ' 15' ' ' LEU . 8.8 p -157.06 162.96 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.538 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.22 142.17 28.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.016 0.436 . . . . 0.0 110.857 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.427 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.6 OUTLIER -116.05 123.64 48.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.836 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.517 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -57.43 96.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.077 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.98 -87.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.223 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 138' ' ' ALA . 6.5 t0 -96.64 -47.13 6.03 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.988 -177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -84.88 157.31 20.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.083 0.468 . . . . 0.0 111.746 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.795 HG11 HG22 ' A' ' 120' ' ' THR . 7.6 p -107.68 149.51 10.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.621 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -131.92 163.24 28.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.008 0.432 . . . . 0.0 111.403 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -63.59 165.38 8.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.964 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.64 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.2 mp -81.03 -32.76 33.99 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -91.34 -49.26 6.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.903 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.425 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 80.8 m -50.44 -38.93 46.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.795 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.5 t80 -56.91 118.38 4.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.233 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.09 179.24 2.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.048 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -85.33 150.09 25.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.971 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 152' ' ' VAL . 8.2 m -72.17 -34.64 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.144 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.694 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -102.95 -51.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 14.0 m -66.02 -28.05 68.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.982 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.9 mmtm 57.79 40.71 25.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.132 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -128.96 143.16 50.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.972 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.701 ' C ' HD22 ' A' ' 157' ' ' LEU . 13.9 mp0 -61.35 172.36 1.15 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.954 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 156' ' ' GLN . 1.8 mm? -127.45 164.62 21.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.414 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 158.91 43.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.033 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.4 t -43.01 129.46 4.44 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.619 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.75 -27.95 16.85 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.553 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.545 ' O ' HG23 ' A' ' 10' ' ' VAL . 30.1 m-20 -70.27 129.13 38.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.772 0.32 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -89.31 114.92 26.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.972 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.2 p90 -129.64 152.05 49.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.509 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 23.0 m-85 -101.48 139.31 37.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.739 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.517 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -99.94 127.09 46.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.707 179.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.4 mmt -90.66 161.92 15.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.039 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -23.6 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.196 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -96.05 27.45 3.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.093 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.06 30.09 15.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.099 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.55 154.52 19.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.862 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.795 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -109.25 121.73 45.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.024 -179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 172' ' ' VAL . 7.6 p -145.08 121.67 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.002 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 21.7 p -76.07 -169.27 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -43.39 54.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.283 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.05 -52.25 61.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.6 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 10.1 p30 -84.98 4.06 35.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.64 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.0 t80 -67.53 -66.11 0.6 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.881 0.372 . . . . 0.0 110.83 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.13 -23.53 65.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 75.2 m -84.64 -32.75 23.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.046 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -89.91 -29.66 18.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.284 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 61.79 175.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.7 p . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.792 0.33 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -130.44 126.25 36.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -153.27 82.59 1.19 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.5 HG12 HG11 ' A' ' 7' ' ' VAL . 12.7 m -106.96 82.69 1.14 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.16 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.59 -45.64 1.09 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.574 2.182 . . . . 0.0 112.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -159.3 38.86 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.617 HG23 ' CE1' ' A' ' 164' ' ' TYR . 12.5 p -72.85 158.43 6.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.12 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.66 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.11 178.73 6.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.663 179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.543 HG23 ' HA ' ' A' ' 162' ' ' GLU . 9.4 p -154.96 135.39 4.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.248 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' CD1' ' A' ' 163' ' ' PHE . 61.4 t -53.54 146.3 3.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.592 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.585 ' C ' HG23 ' A' ' 159' ' ' THR . . . -139.35 -148.63 5.27 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.657 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 13' ' ' PRO . 25.3 mt-10 -72.98 115.28 38.74 Favored Pre-proline 0 C--N 1.329 -0.323 0 O-C-N 122.906 -0.173 . . . . 0.0 110.73 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.558 ' O ' HG12 ' A' ' 134' ' ' VAL . 27.2 Cg_endo -62.3 135.41 53.91 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.251 1.967 . . . . 0.0 112.213 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.23 167.9 27.77 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.42 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CG2' ' A' ' 129' ' ' ILE . 1.4 mt -143.99 173.91 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.226 0.536 . . . . 0.0 111.746 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.427 ' CE ' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.96 -35.99 71.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.501 179.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.824 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.99 94.78 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.589 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 148.43 103.33 0.31 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.298 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.407 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 16.5 mt-10 -50.91 -71.71 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.833 0.349 . . . . 0.0 111.069 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.404 ' HB2' ' CE1' ' A' ' 115' ' ' PHE . 29.0 t80 -176.94 -66.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 144.91 120.97 1.41 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.489 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -83.95 -44.22 14.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -29.69 68.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.972 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -58.79 -31.34 68.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.962 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' HG2' ' CD2' ' A' ' 102' ' ' PHE . 6.6 tp10 -109.23 160.68 15.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.933 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.29 101.92 5.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.901 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.643 HD11 ' HB3' ' A' ' 100' ' ' ARG . 0.7 OUTLIER -76.89 164.95 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.85 179.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.795 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 7.8 pt -62.95 147.88 11.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.22 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 27.8 m -114.88 106.91 14.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.757 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.77 101.83 7.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.626 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -145.65 146.86 31.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.947 -179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -75.4 147.75 39.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.89 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -104.87 160.14 15.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.6 t -98.7 32.56 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -105.63 78.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.869 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -94.23 -33.32 13.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.912 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -131.86 82.23 2.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.66 82.47 1.66 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.079 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 63.09 18.09 10.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.506 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -173.77 -64.67 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.879 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 64.3 -81.01 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.508 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.528 ' O ' HG23 ' A' ' 42' ' ' ILE . 10.6 tp -54.62 119.15 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.315 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -80.63 -42.14 22.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.816 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.24 90.04 7.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.94 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -103.99 116.85 32.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.953 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -63.88 -146.57 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.549 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.42 62.41 0.49 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.518 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 m -99.39 152.8 19.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.824 0.345 . . . . 0.0 110.86 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 165.95 -141.63 7.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.56 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 151.84 -84.92 0.15 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.458 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 45.3 m-70 -104.39 -49.48 3.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.768 0.318 . . . . 0.0 110.871 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.1 ttt -164.91 114.84 1.12 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.924 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.93 148.01 42.35 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.5 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.41 131.98 40.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 110.912 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -176.09 122.62 0.87 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.526 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 136.44 95.89 0.44 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.471 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -107.7 85.2 2.26 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.665 0.269 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.12 164.57 33.41 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.542 2.161 . . . . 0.0 112.27 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 59.5 30.81 20.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.925 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.716 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -103.81 134.75 19.56 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.034 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.455 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.3 Cg_endo -58.72 125.93 19.73 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.415 2.077 . . . . 0.0 112.056 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.33 138.51 31.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.13 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.8 p -57.98 164.27 2.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.963 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.555 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.86 114.66 24.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.501 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.59 -71.1 0.45 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.527 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 13.6 p -103.59 153.07 21.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.826 0.346 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -74.03 87.04 1.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.065 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -179.05 137.74 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.908 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.716 ' CD2' HG21 ' A' ' 60' ' ' ILE . 12.3 p80 -76.53 145.8 38.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -73.53 153.76 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.94 35.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.961 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.425 ' HB2' HD11 ' A' ' 75' ' ' ILE . 3.9 m-20 -110.59 159.61 17.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.887 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -60.11 -75.25 0.06 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.842 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -74.86 112.12 10.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.444 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.3 mm -120.93 152.81 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.226 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.9 mp -111.79 106.78 15.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.1 tttt -90.81 128.01 36.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.795 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -161.48 158.95 27.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.261 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.677 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.6 OUTLIER 59.57 38.45 22.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.09 179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 61.43 29.32 18.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.72 -173.9 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.866 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.409 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 23.4 p-80 -105.34 124.31 49.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.677 ' NE1' HD12 ' A' ' 79' ' ' LEU . 49.3 m95 -112.37 130.77 55.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.714 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.569 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -57.14 171.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.1 -39.98 28.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.003 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.4 tttt -91.03 -29.79 17.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.02 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 74.6 m -67.13 -30.73 70.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.957 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.464 ' CD2' HG21 ' A' ' 28' ' ' ILE . 1.6 tp -69.5 90.61 0.55 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.914 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.8 mttt -148.42 148.27 30.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.846 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.8 t -58.13 147.04 31.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 t -74.75 -29.1 61.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.252 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -99.26 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.847 0.356 . . . . 0.0 111.16 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.437 ' HB2' HG22 ' A' ' 95' ' ' VAL . 15.9 m -61.7 -32.57 72.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.053 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 54.15 24.73 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.129 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.437 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -83.9 146.7 49.67 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.138 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.63 118.99 5.69 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.533 2.155 . . . . 0.0 112.268 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 mp -114.32 108.66 17.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.8 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -136.88 30.99 2.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.174 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.743 ' C ' HD11 ' A' ' 28' ' ' ILE . 12.0 mt-10 -139.78 -47.08 0.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.877 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.643 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -134.43 174.21 10.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.762 ' HB2' HG23 ' A' ' 28' ' ' ILE . 48.0 t -157.0 127.98 6.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.948 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 50.2 t80 -129.93 120.64 25.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.482 ' OG ' HD22 ' A' ' 79' ' ' LEU . 93.2 p -138.0 156.1 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.878 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 8.5 mtt85 -154.03 124.43 7.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.931 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 88.18 -54.15 4.22 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.532 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -176.33 -42.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.796 0.331 . . . . 0.0 110.88 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 58.6 m -78.73 151.29 32.19 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.832 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 108' ' ' VAL . 13.0 p -114.12 122.75 68.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.049 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.467 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -145.54 133.08 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 17.9 p -55.59 148.38 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.436 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 1.8 mtmp? -64.09 -19.98 65.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.313 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 t0 -46.62 -58.07 4.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.818 0.342 . . . . 0.0 111.323 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -77.68 -20.62 53.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.075 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.505 ' CZ ' ' CD2' ' A' ' 118' ' ' PHE . 11.1 t80 -58.16 -27.89 64.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.899 0.381 . . . . 0.0 110.695 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 1.9 m-85 -73.04 -28.77 62.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -82.31 -31.8 29.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.503 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.438 ' HD3' ' CE2' ' A' ' 118' ' ' PHE . 9.1 ptp180 -88.57 -37.25 15.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.443 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.505 ' CD2' ' CZ ' ' A' ' 114' ' ' PHE . 93.9 m-85 -103.36 -43.11 5.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.888 0.375 . . . . 0.0 111.151 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -70.31 170.83 44.37 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.468 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 71.5 m -58.65 152.36 18.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 110.805 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -138.65 172.33 13.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.037 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.499 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -85.27 129.61 34.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.958 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.51 30.62 3.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.034 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.848 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.08 -56.17 1.56 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.7 p -107.83 -20.12 13.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.162 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 68.63 70.74 0.29 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.84 0.353 . . . . 0.0 110.868 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 127' ' ' LEU . 3.9 tp -130.28 -165.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.842 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -105.48 99.35 1.56 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.678 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.705 HG23 HE21 ' A' ' 133' ' ' GLN . 16.1 mt -75.73 125.59 88.23 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.47 0.176 . . . . 0.0 110.719 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.613 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.8 Cg_exo -51.62 -180.0 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.141 1.894 . . . . 0.0 111.96 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 74.4 Cg_endo -77.32 -49.39 0.1 Allowed 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.398 2.065 . . . . 0.0 113.818 -179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.824 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.8 21.72 7.58 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.705 HE21 HG23 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -55.71 146.47 21.08 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.277 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.558 HG12 ' O ' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -88.87 108.92 19.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.998 0.427 . . . . 0.0 111.028 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.516 HG12 ' HG ' ' A' ' 15' ' ' LEU . 12.0 p -153.25 159.33 3.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.105 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.493 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.77 137.64 35.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.666 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.477 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.1 OUTLIER -105.01 150.86 24.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.852 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -92.43 96.49 10.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.698 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 51.86 -87.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.178 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.413 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.8 OUTLIER -93.57 -46.88 7.09 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.843 -177.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.402 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 7.9 m-85 -87.27 166.92 14.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.679 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.477 HG23 ' CG ' ' A' ' 137' ' ' ARG . 7.3 p -119.82 127.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.785 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.848 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 4.3 m-85 -110.06 134.78 51.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.989 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 71.1 m80 -59.52 138.95 57.53 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.853 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.41 HD23 ' OE1' ' A' ' 133' ' ' GLN . 0.8 OUTLIER -60.43 -19.64 57.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.453 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -85.06 -37.88 19.8 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.9 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.7 p -98.16 12.88 33.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.55 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.852 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 3.4 t80 -86.14 121.92 29.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.735 0.302 . . . . 0.0 110.832 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.11 -176.98 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.122 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.74 150.08 24.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 152' ' ' VAL . 4.7 m -66.08 -30.32 49.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.114 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.66 HG23 HG23 ' A' ' 151' ' ' VAL . 27.9 t -111.81 -52.2 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.108 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 15.3 m -65.99 -28.05 68.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.994 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt 57.66 32.58 22.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.998 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -111.93 133.96 53.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.989 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.625 ' O ' HD13 ' A' ' 157' ' ' LEU . 6.0 mt-30 -62.3 157.91 18.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.124 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.735 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.3 OUTLIER -126.74 125.41 41.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.645 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -104.05 177.73 4.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.409 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.585 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.1 m -45.61 129.31 8.81 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.668 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.88 -27.09 15.6 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.792 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -59.58 128.97 39.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.76 0.314 . . . . 0.0 110.793 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.543 ' HA ' HG23 ' A' ' 9' ' ' VAL . 40.2 mt-10 -87.91 129.61 35.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.039 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.66 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 10.9 p90 -150.75 154.13 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.006 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.617 ' CE1' HG23 ' A' ' 7' ' ' VAL . 19.6 m-85 -106.46 171.02 7.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.852 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -128.47 111.03 12.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.827 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mmt -59.91 -178.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.947 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -27.52 33.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -97.5 29.68 3.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.076 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.48 83.63 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.413 ' HB3' HG11 ' A' ' 151' ' ' VAL . 8.6 mtp180 -150.37 147.12 27.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.852 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -90.99 121.03 32.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.923 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.407 ' O ' HG13 ' A' ' 172' ' ' VAL . 9.4 p -145.09 126.39 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.949 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.1 p -78.07 -175.39 4.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.818 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.6 mttt -78.57 -26.94 45.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.13 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.94 78.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.35 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -103.92 -4.51 23.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.673 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -56.99 -66.19 0.49 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.017 0.437 . . . . 0.0 110.82 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -58.75 -27.2 64.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.873 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.8 -39.75 61.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.12 4.05 51.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.599 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.04 -177.41 0.1 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.957 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.86 0.362 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -74.0 -73.94 0.21 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.895 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -107.48 146.59 31.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 4' ' ' VAL . 7.8 m -122.06 83.09 44.34 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.111 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.52 -61.63 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.568 2.178 . . . . 0.0 112.291 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -155.49 85.7 1.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.935 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.621 HG23 ' CE1' ' A' ' 164' ' ' TYR . 11.0 p -126.0 158.83 35.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.486 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.1 OUTLIER -112.45 -176.94 3.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.643 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.462 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.1 p -155.14 136.53 5.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.345 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 48.3 t -61.38 145.54 12.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.649 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -122.14 -171.07 13.87 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.429 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.6 mt-10 -61.03 149.19 82.6 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.932 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.0 Cg_endo -78.27 138.79 16.21 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.593 2.195 . . . . 0.0 112.373 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -164.11 142.91 7.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.265 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -119.82 173.54 6.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.129 0.49 . . . . 0.0 111.455 -179.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.469 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.44 -36.13 82.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.801 179.851 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.882 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.53 98.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.544 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.33 -76.95 0.12 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.568 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 61.05 77.37 0.33 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.785 0.326 . . . . 0.0 110.837 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.513 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 11.1 p90 -59.43 -39.51 83.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.957 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 65.17 179.77 8.05 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.638 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.555 ' HB3' HD22 ' A' ' 27' ' ' LEU . 2.9 p30 -57.63 -21.98 42.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.692 0.282 . . . . 0.0 111.195 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -54.45 -27.62 38.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.197 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.66 -77.91 0.12 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.943 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 53.6 tp10 -92.75 156.28 17.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.991 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -76.02 100.05 4.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.839 HD21 ' HG2' ' A' ' 100' ' ' ARG . 2.4 tp -65.22 160.15 22.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 88' ' ' LEU . 1.6 pt -63.0 141.29 18.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.105 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.9 m -115.96 106.97 14.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.752 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -78.47 101.91 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.794 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.469 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -141.94 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.965 -179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -69.22 156.96 37.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -100.78 -170.07 1.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.888 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.8 t -98.83 -33.29 10.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.64 173.13 1.8 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.423 ' CE2' ' HD3' ' A' ' 73' ' ' ARG . 0.7 OUTLIER -176.24 -43.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -128.49 31.55 4.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.911 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.32 -31.23 63.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.103 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.961 ' HB3' HD13 ' A' ' 71' ' ' LEU . . . -162.62 108.84 1.22 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.056 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 60.67 -175.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.919 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 106.27 -63.52 0.3 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.476 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.458 ' O ' HG23 ' A' ' 42' ' ' ILE . 9.8 tp -54.68 125.06 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.827 0.346 . . . . 0.0 111.423 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 60.4 178.63 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.896 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.74 84.55 2.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -82.97 125.17 31.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.868 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.69 140.76 5.51 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.503 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.22 -50.68 1.07 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.558 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.2 t -99.88 140.38 34.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.337 . . . . 0.0 110.854 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.98 135.7 8.44 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.536 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -171.41 114.1 0.52 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.451 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -93.22 138.85 31.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.78 0.324 . . . . 0.0 110.956 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 5.2 ttp -85.23 -56.83 3.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -60.5 -94.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.553 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.78 -68.55 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.864 0.364 . . . . 0.0 110.85 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 59.53 165.12 0.14 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.503 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 157.1 -162.33 31.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.506 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.11 89.52 2.53 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.653 0.263 . . . . 0.0 110.933 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.73 161.86 41.92 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.528 2.152 . . . . 0.0 112.191 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 59.73 31.18 20.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.763 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.721 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -104.72 134.73 19.51 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.046 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.8 Cg_endo -60.8 125.94 18.46 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.405 2.07 . . . . 0.0 112.102 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.71 140.44 32.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 p -57.59 164.2 2.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.0 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -85.12 114.67 22.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.569 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.13 -72.82 0.38 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.558 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.3 p -100.72 154.04 18.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.785 0.326 . . . . 0.0 110.962 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -76.03 86.22 2.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.158 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.04 127.63 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.721 ' CD2' HG21 ' A' ' 60' ' ' ILE . 10.1 p80 -63.97 161.84 15.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.933 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.574 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.8 mm -94.5 153.09 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.968 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.961 HD13 ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -162.12 30.34 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.921 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -103.67 176.16 5.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.934 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.423 ' HD3' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -83.06 -78.32 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.708 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.26 97.37 0.93 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.755 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.633 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.9 141.34 20.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.633 ' H ' HD13 ' A' ' 75' ' ' ILE . 8.6 mp -89.81 106.98 18.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.621 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -90.9 115.53 28.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.691 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.752 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -157.02 158.93 37.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.261 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.789 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 59.33 36.77 23.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.077 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 62.18 30.22 17.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.071 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.6 mtt180 -168.22 178.77 4.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.964 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.452 ' HB2' HD12 ' A' ' 75' ' ' ILE . 27.3 p-80 -96.56 125.05 40.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.789 ' NE1' HD12 ' A' ' 79' ' ' LEU . 36.8 m95 -113.72 133.21 55.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.772 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.456 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.69 173.1 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.927 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -79.99 -40.65 27.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -90.97 -30.71 16.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -67.3 -31.03 71.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.983 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 28' ' ' ILE . 22.8 tp -71.7 81.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -138.55 164.11 30.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.879 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.14 146.89 43.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.925 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.17 -27.41 68.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.059 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -111.73 -57.77 2.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.038 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -59.25 -45.17 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.068 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 61.09 23.25 13.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.1 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.505 ' O ' HD13 ' A' ' 97' ' ' LEU . 5.0 m -86.57 157.77 55.05 Favored Pre-proline 0 N--CA 1.453 -0.318 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.164 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.14 118.96 5.93 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.482 2.121 . . . . 0.0 112.167 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 95' ' ' VAL . 7.1 mp -110.05 35.95 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.659 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.54 -17.82 63.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.559 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.816 ' C ' HD11 ' A' ' 28' ' ' ILE . 14.6 mt-10 -91.35 -55.34 3.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.755 0.312 . . . . 0.0 110.987 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.839 ' HG2' HD21 ' A' ' 27' ' ' LEU . 1.4 mpt_? -142.6 160.97 39.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.849 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.577 ' HB3' HG23 ' A' ' 28' ' ' ILE . 52.8 t -157.06 127.95 6.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.532 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.5 OUTLIER -105.89 160.63 15.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.723 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.7 p -139.75 157.62 45.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.031 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 109' ' ' TYR . 2.8 mmp_? -141.31 172.06 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.818 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -62.42 -26.78 68.48 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.566 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -90.08 -71.1 0.63 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.784 0.326 . . . . 0.0 110.976 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.06 -173.23 3.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.972 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.5 p -99.5 123.33 52.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.16 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.421 ' CE2' ' HG3' ' A' ' 104' ' ' ARG . 1.1 m-85 -121.49 161.57 22.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 15.1 p -82.92 168.38 17.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.713 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 1.0 OUTLIER -57.9 -35.99 71.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.022 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.437 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 4.4 t70 -76.33 -23.6 54.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.194 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.6 -21.06 49.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.407 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.513 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 11.6 t80 -67.64 -44.89 76.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.894 0.378 . . . . 0.0 110.813 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.497 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 17.3 m-85 -59.6 -42.89 93.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.871 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.71 -28.01 40.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.306 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.5 mmt-85 -78.08 -54.97 5.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.217 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -110.88 -43.06 3.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.168 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -57.15 168.88 3.89 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.636 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 84.8 m -65.3 153.26 41.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.741 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -145.24 162.1 37.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.972 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.555 ' CA ' HD11 ' A' ' 129' ' ' ILE . 42.1 t -77.94 128.67 34.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.96 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.34 30.67 3.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.04 -49.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 30.9 p -116.57 -0.92 12.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.421 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.605 ' O ' HD12 ' A' ' 127' ' ' LEU . 2.2 mp0 62.6 69.99 0.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.922 0.391 . . . . 0.0 110.928 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.605 HD12 ' O ' ' A' ' 126' ' ' GLN . 1.1 mp -146.83 143.0 28.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.778 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.4 104.34 1.84 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.702 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.555 HD11 ' CA ' ' A' ' 122' ' ' CYS . 1.7 mp -72.07 138.23 82.0 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.507 0.194 . . . . 0.0 110.708 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 94.6 Cg_exo -43.08 171.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.746 2.297 . . . . 0.0 112.844 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -70.39 -55.2 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.835 2.357 . . . . 0.0 113.828 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.882 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.95 21.46 7.52 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.243 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.604 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.5 OUTLIER -63.43 139.11 58.74 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.484 179.768 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.932 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -73.44 108.76 5.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.039 0.447 . . . . 0.0 111.007 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.7 p -146.11 160.47 11.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.85 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.514 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.32 134.85 38.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 179.769 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.45 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -114.13 130.57 56.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.923 -179.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -66.59 96.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.72 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 46.76 -88.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.491 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 138' ' ' ALA . 19.4 p-10 -89.24 -43.89 10.66 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.879 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.422 ' CD2' ' OD1' ' A' ' 140' ' ' ASP . 5.8 m-85 -89.32 164.14 15.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.989 0.423 . . . . 0.0 111.682 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.486 ' CG1' HD13 ' A' ' 129' ' ' ILE . 9.3 p -114.04 149.33 16.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.71 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -132.3 174.91 9.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.112 0.482 . . . . 0.0 111.383 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.412 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 47.2 m80 -98.22 144.21 27.9 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.879 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.655 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -63.01 -17.92 62.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.389 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.25 -47.95 7.2 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.798 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -84.4 -31.61 24.6 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.676 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.855 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 31.7 t80 -56.84 110.19 0.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.836 0.351 . . . . 0.0 110.86 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -161.17 -176.97 5.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.074 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.5 150.03 28.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.019 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 171' ' ' LEU . 11.7 m -64.73 -29.42 47.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.263 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.749 HG23 HG23 ' A' ' 151' ' ' VAL . 21.1 t -110.9 -51.6 6.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.184 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 38.4 m -65.94 -28.09 68.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.06 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 7.9 mmtm 53.15 30.6 10.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.13 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -111.1 140.03 45.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.962 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.431 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.9 mp0 -61.78 156.17 21.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.901 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -117.88 168.11 10.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.844 -179.974 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.1 168.85 19.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.022 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.6 t -47.96 126.69 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.26 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.47 -25.27 27.45 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.627 -0.796 . . . . 0.0 112.736 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.462 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.3 t70 -66.63 128.82 37.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.698 0.285 . . . . 0.0 110.656 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -91.38 119.07 31.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.19 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.643 ' CD2' HD23 ' A' ' 171' ' ' LEU . 3.4 p90 -138.71 164.6 29.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.837 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.621 ' CE1' HG23 ' A' ' 7' ' ' VAL . 76.8 m-85 -112.63 156.84 22.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.862 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.525 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -116.19 113.33 22.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.7 mmt -58.13 177.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.956 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 14.9 mp0 -58.28 -49.02 78.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.993 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 90.5 m-20 -74.3 -78.86 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.902 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 40.7 p -177.24 37.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.796 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -93.3 144.93 24.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.932 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.855 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.3 OUTLIER -94.59 120.96 35.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.603 HG13 ' HB2' ' A' ' 164' ' ' TYR . 10.0 p -139.73 130.58 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.068 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 28.6 p -86.13 -172.4 4.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.428 ' NZ ' HG21 ' A' ' 7' ' ' VAL . 1.1 mptp? -63.75 -57.76 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.032 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -54.38 -29.44 48.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.297 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.472 ' CB ' HG23 ' A' ' 172' ' ' VAL . 58.1 m-20 -90.04 -23.46 21.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.022 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.467 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.3 t80 -56.12 -66.12 0.48 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.953 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -60.26 -44.91 94.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 65.9 m -61.26 -31.5 71.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.835 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -76.07 -51.35 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.69 -67.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.928 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . 0.421 ' HB3' ' CE2' ' A' ' 177' ' ' TYR . 0.9 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.875 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.856 0.36 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -102.96 114.43 28.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.875 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.469 ' O ' HG13 ' A' ' 4' ' ' VAL . 8.0 tp60 67.73 -69.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.998 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.703 HG21 ' CG1' ' A' ' 7' ' ' VAL . 14.8 m -157.66 149.36 17.11 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.098 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.51 -45.55 1.15 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.526 2.151 . . . . 0.0 112.375 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -167.56 82.3 0.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.703 ' CG1' HG21 ' A' ' 4' ' ' VAL . 12.1 p -95.8 158.63 3.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.067 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.558 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -155.62 -176.94 6.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.558 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 4.1 p -150.77 150.61 13.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.352 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.737 HG21 ' HB3' ' A' ' 157' ' ' LEU . 24.3 t -66.92 146.42 13.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.831 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.7 -179.65 16.58 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.385 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -57.4 139.39 80.49 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.475 0.179 . . . . 0.0 110.678 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.651 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.84 140.49 61.38 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.364 2.043 . . . . 0.0 112.493 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -166.14 142.94 5.15 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.257 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.801 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -114.89 173.26 6.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.079 0.466 . . . . 0.0 111.333 -179.553 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.635 ' HE3' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -62.77 -34.35 77.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.788 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.851 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.18 65.23 3.66 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.417 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -153.6 82.22 0.17 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.622 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -84.2 5.05 27.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.547 0.213 . . . . 0.0 111.225 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.409 ' CE2' ' CD1' ' A' ' 114' ' ' PHE . 2.9 m-85 69.89 -67.04 0.25 Allowed 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.816 0.341 . . . . 0.0 110.883 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 126.36 133.88 3.95 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.597 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.02 -30.39 26.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.904 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.88 -31.15 71.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.52 -75.09 0.05 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG2' ' CD1' ' A' ' 102' ' ' PHE . 9.1 tp10 -60.06 165.37 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.878 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -75.91 99.95 4.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.719 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.611 HD11 ' CB ' ' A' ' 100' ' ' ARG . 3.1 tp -86.0 165.0 17.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.012 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.854 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.96 149.92 9.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.9 m -122.59 106.88 11.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.796 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -80.62 101.76 9.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.505 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -146.17 166.04 27.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.036 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -81.26 157.04 25.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.96 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -102.78 174.47 5.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.826 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 p -103.0 35.92 2.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.914 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -128.4 161.73 28.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -166.25 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -150.61 80.22 1.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.79 -68.97 0.8 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.12 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.14 117.13 7.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 60.61 31.49 20.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.895 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -83.39 -102.99 0.52 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 42' ' ' ILE . 10.7 tp -54.65 128.88 15.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.805 0.336 . . . . 0.0 111.424 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 t0 60.55 158.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.94 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -100.97 141.53 33.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.897 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.27 -32.77 69.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.84 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.7 -148.18 21.65 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.544 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -104.09 71.33 0.26 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.555 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 49.4 m -95.01 114.16 25.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.308 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -97.61 86.64 0.83 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 140.61 -159.15 26.31 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.491 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 60.57 33.13 20.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.842 0.353 . . . . 0.0 110.88 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.0 ttp 60.41 80.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.878 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -95.55 -28.54 9.53 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.499 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -60.32 162.72 5.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 104.89 -138.64 14.28 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.516 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 136.14 179.82 17.06 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.528 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.34 83.0 1.05 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.909 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.03 168.98 19.03 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.527 2.151 . . . . 0.0 112.156 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 57.85 29.88 18.2 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.866 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.437 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.1 tp -98.69 135.18 21.12 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.056 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.3 Cg_endo -60.35 125.87 18.58 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.35 2.034 . . . . 0.0 111.964 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.414 ' HA ' ' HA ' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -102.71 151.14 22.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.153 -179.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.451 ' HA ' ' CD2' ' A' ' 82' ' ' HIS . 4.5 t -58.16 137.73 56.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.787 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.458 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -62.5 114.65 3.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.172 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.05 25.68 39.81 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.054 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -130.11 -178.9 4.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.931 0.396 . . . . 0.0 110.917 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -112.76 -30.74 6.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.182 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.95 -168.7 1.6 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.063 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 62' ' ' MET . 2.1 p80 -102.36 172.42 6.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.906 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.655 ' C ' HD23 ' A' ' 71' ' ' LEU . 12.8 mm -98.06 154.13 3.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.297 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.655 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -167.02 32.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.68 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -99.17 -179.06 4.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.894 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.25 -67.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.55 133.65 33.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.067 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.435 ' C ' HD12 ' A' ' 76' ' ' LEU . 41.9 mm -138.89 151.42 23.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.111 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 76' ' ' LEU . 6.2 mp -105.05 106.95 17.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.528 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -90.96 115.02 27.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.025 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.82 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -147.75 159.4 43.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.071 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.527 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.33 36.1 24.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.076 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 62.47 39.59 11.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.115 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -174.03 162.89 3.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.952 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.451 ' CD2' ' HA ' ' A' ' 63' ' ' CYS . 43.1 p-80 -86.79 117.88 25.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.959 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.527 ' NE1' HD12 ' A' ' 79' ' ' LEU . 86.0 m95 -108.09 124.6 50.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.74 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.09 174.45 0.12 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.964 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.7 t -80.06 -38.37 32.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.353 179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -91.19 -22.17 20.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.958 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.7 m -95.53 26.76 3.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.988 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.854 HD21 HG21 ' A' ' 28' ' ' ILE . 56.0 tp -129.89 88.68 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.835 0.35 . . . . 0.0 111.023 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.35 161.54 37.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -59.02 147.0 36.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -75.6 -31.07 59.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.864 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -95.8 -60.6 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 18.9 m -60.25 -34.83 74.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.873 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 58.19 31.15 20.41 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.014 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.467 ' O ' HD13 ' A' ' 97' ' ' LEU . 17.0 t -97.86 133.01 23.8 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.99 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.1 118.97 3.1 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.542 2.162 . . . . 0.0 112.557 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 95' ' ' VAL . 5.6 mp -101.86 77.47 1.72 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.825 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -108.92 38.15 2.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -152.68 -66.31 0.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.611 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -127.04 133.86 50.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.837 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.736 ' SG ' HD11 ' A' ' 88' ' ' LEU . 1.9 t -123.36 128.04 49.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.907 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.418 ' CD1' ' HG2' ' A' ' 25' ' ' GLU . 0.4 OUTLIER -112.35 153.64 26.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.2 t -127.43 117.82 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.881 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -149.71 123.96 9.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.889 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 67.47 50.22 45.39 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.482 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 68.91 -67.2 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.317 . . . . 0.0 110.932 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.4 m -58.43 151.2 20.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.952 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 11.6 p -78.06 134.76 27.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.047 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -122.94 156.38 34.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.937 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 14.4 p -112.78 135.94 52.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.692 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.447 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -51.97 -35.57 46.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.188 -179.8 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -45.14 -48.89 12.2 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.45 -20.8 33.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.85 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.46 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 11.1 t80 -64.13 -34.96 79.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.944 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.447 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 40.6 m-85 -65.11 -40.94 95.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.93 0.395 . . . . 0.0 110.756 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -74.8 -56.52 4.69 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.311 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -73.49 -51.92 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.468 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 96.6 m-85 -98.53 37.01 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.203 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.99 -143.71 3.86 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.295 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.635 ' HB ' ' HE3' ' A' ' 16' ' ' MET . 80.7 m -103.07 155.0 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.711 0.291 . . . . 0.0 110.814 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -151.62 158.42 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.875 0.369 . . . . 0.0 111.191 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.468 ' HA ' HD11 ' A' ' 129' ' ' ILE . 52.1 t -74.28 136.78 42.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.722 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.46 30.23 2.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.23 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -58.15 1.47 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.174 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 18.0 p -110.37 18.2 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.211 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 54.41 28.37 9.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.778 0.323 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.426 HD23 ' CE1' ' A' ' 144' ' ' HIS . 14.4 tp -100.86 134.71 43.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.829 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.0 110.87 3.43 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.625 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.786 HG22 HD11 ' A' ' 15' ' ' LEU . 11.4 mt -63.7 139.56 97.64 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 120.555 0.216 . . . . 0.0 110.895 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.573 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 91.9 Cg_exo -44.59 172.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.672 2.248 . . . . 0.0 112.598 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.09 -55.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.908 2.405 . . . . 0.0 114.464 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.851 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.32 21.39 7.29 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -177.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.573 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 67.0 mm-40 -61.22 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.471 179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.768 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -118.81 112.16 36.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.946 0.403 . . . . 0.0 111.079 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.801 HG12 ' HG ' ' A' ' 15' ' ' LEU . 8.7 p -157.05 161.39 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.733 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.531 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.25 134.92 38.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.639 179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.837 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -113.91 136.57 52.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.811 -179.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -72.68 96.32 1.99 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.861 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 38.1 -89.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.2 m-20 -79.05 -38.5 36.3 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.088 -0.96 . . . . 0.0 112.205 -177.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.41 ' O ' ' N ' ' A' ' 138' ' ' ALA . 5.7 m-85 -105.84 168.19 9.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.837 HG22 ' CB ' ' A' ' 137' ' ' ARG . 46.9 t -122.58 148.12 26.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.514 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.572 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.9 m-85 -133.56 170.18 15.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.118 0.485 . . . . 0.0 111.733 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 0.1 OUTLIER -65.83 168.78 7.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.907 179.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.768 HD21 ' O ' ' A' ' 134' ' ' VAL . 5.5 mp -81.04 -29.96 34.96 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 177.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -91.42 -49.3 6.41 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.11 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 79.7 m -53.69 -33.17 54.57 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.245 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.675 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 2.6 t80 -56.84 114.58 2.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.021 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.1 -177.02 1.78 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 153' ' ' CYS . 30.6 t -97.68 150.07 21.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 152' ' ' VAL . 21.3 m -66.81 -26.29 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.283 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.683 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -106.22 -55.88 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.345 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 150' ' ' CYS . 25.8 m -65.84 -28.19 68.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.005 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? 54.73 31.65 15.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.69 146.83 46.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.855 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.6 mp0 -62.19 154.13 28.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.737 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.7 mm? -112.16 123.27 49.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.827 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -98.88 157.67 16.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.0 t -44.69 133.51 5.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.546 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 105.26 -32.98 6.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.628 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.519 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.3 OUTLIER -67.15 131.06 45.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.789 0.328 . . . . 0.0 110.812 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -88.04 113.89 24.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.031 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.784 ' CD2' HD23 ' A' ' 171' ' ' LEU . 9.0 p90 -126.49 153.27 45.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.927 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.435 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 28.7 m-85 -102.16 163.27 12.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.743 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.6 tp -120.7 112.11 18.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.801 179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.14 167.85 2.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.36 -29.65 67.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.016 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.5 -79.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.038 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.43 38.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.823 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -105.54 117.58 34.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.851 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.784 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -69.4 127.22 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.07 126.66 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.056 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.1 m -58.77 -170.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.811 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.4 mttm -73.42 -55.86 5.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.71 -43.91 97.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.101 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -59.37 -25.76 64.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.056 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -55.83 -66.09 0.48 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.999 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -56.44 -28.14 58.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.118 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -30.5 43.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.985 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -90.45 -29.18 18.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.246 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm 61.88 174.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.847 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.853 -179.917 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.811 0.339 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t -154.98 161.63 41.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.957 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -175.63 115.69 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -131.79 150.34 75.94 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.075 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.89 -167.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.529 2.153 . . . . 0.0 112.298 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -124.51 112.58 17.04 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.937 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.491 HG22 ' N ' ' A' ' 8' ' ' MET . 10.9 p -126.05 158.6 35.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.072 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -139.51 -177.4 4.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.639 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.443 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.9 p -155.06 135.7 4.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.227 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.451 HG22 ' CE1' ' A' ' 163' ' ' PHE . 57.5 t -58.9 146.17 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.483 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.01 -153.18 8.7 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.664 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 60.0 mt-10 -67.66 141.51 95.19 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.534 0.207 . . . . 0.0 110.748 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.604 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.0 Cg_endo -83.03 129.91 5.48 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.716 2.277 . . . . 0.0 112.396 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.2 OUTLIER -156.43 155.17 31.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.349 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.558 HD21 ' CG1' ' A' ' 135' ' ' VAL . 8.2 mt -136.28 173.38 11.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.874 0.369 . . . . 0.0 111.091 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.409 ' HE3' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.66 -50.66 32.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.777 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.857 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 63.13 88.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.583 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -174.98 -41.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.424 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 58.4 23.27 10.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.75 0.31 . . . . 0.0 111.026 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.484 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 56.95 -172.91 0.08 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.872 -179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -142.18 136.76 7.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.89 -31.23 61.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.748 0.308 . . . . 0.0 110.854 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -74.15 -27.9 61.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.038 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -56.31 -31.18 63.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.025 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.7 OUTLIER -113.01 174.19 6.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.844 179.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -75.98 121.61 22.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.834 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' A' ' 100' ' ' ARG . 3.1 tp -105.13 163.68 12.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.839 HG23 ' HB2' ' A' ' 101' ' ' CYS . 8.3 pt -63.04 146.31 12.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.139 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.402 HG22 ' HG ' ' A' ' 31' ' ' LEU . 50.3 m -113.46 106.84 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.833 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -77.08 101.75 6.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.491 179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.579 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.03 155.9 42.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.968 -179.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -77.72 152.35 33.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.928 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -99.24 -27.52 13.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 34' ' ' THR . 8.8 m 63.37 37.56 10.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.817 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -124.44 73.4 1.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.836 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE2' ' NH1' ' A' ' 73' ' ' ARG . 2.2 t80 -70.55 -44.4 67.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.904 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.624 ' CG ' HD11 ' A' ' 42' ' ' ILE . 3.9 m-20 -102.06 141.32 35.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.902 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.12 -40.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.068 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -166.09 107.08 0.71 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 60.35 35.33 20.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -96.62 -29.07 8.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.499 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.631 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.5 mp -84.19 -72.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.816 0.341 . . . . 0.0 110.858 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -72.85 -177.13 2.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.872 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -132.83 125.34 29.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -60.37 162.57 6.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.899 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.85 59.1 0.64 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.569 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -161.3 146.79 12.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.491 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -131.72 -46.46 0.96 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 0.0 110.936 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -60.91 -97.95 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.529 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.75 -162.21 2.54 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.523 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -155.43 100.58 2.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.806 0.336 . . . . 0.0 110.851 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 43.3 mtp -144.08 118.75 9.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.901 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.05 77.45 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.534 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.6 m 60.55 171.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.817 0.341 . . . . 0.0 110.926 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -103.9 -157.51 24.32 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.433 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -91.2 -160.87 36.84 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.483 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.51 87.5 14.19 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.638 0.256 . . . . 0.0 110.9 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.47 165.53 1.02 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.558 2.172 . . . . 0.0 112.265 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 59.71 31.16 20.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.447 HD12 ' HD2' ' A' ' 61' ' ' PRO . 3.3 tp -106.29 134.93 19.56 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.053 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.6 Cg_endo -60.14 125.9 18.79 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.405 2.07 . . . . 0.0 112.031 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 3.5 mtt -99.19 135.94 39.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.43 ' HB2' ' CG1' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -58.03 147.54 29.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.654 179.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.486 ' HB1' ' CE3' ' A' ' 83' ' ' TRP . . . -62.12 114.82 3.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.068 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 97.37 -22.24 41.82 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.967 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.76 -178.82 6.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.805 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -144.4 46.88 1.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.01 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -150.68 -83.35 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.014 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 176.03 -177.55 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.831 0.348 . . . . 0.0 110.933 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.688 ' C ' HD23 ' A' ' 71' ' ' LEU . 7.7 mm -126.93 153.72 36.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.144 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.688 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -172.79 35.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.886 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.401 ' HB2' HD11 ' A' ' 75' ' ' ILE . 23.8 m-20 -100.3 -179.54 4.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' NH1' ' CE2' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -81.73 -79.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.839 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.548 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.4 OUTLIER -77.92 132.75 38.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.018 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.548 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.5 mm -136.03 152.48 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.115 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.0 mp -106.97 106.91 17.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.437 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -90.84 120.83 32.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.109 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.677 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.87 154.75 34.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.114 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.883 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 54.74 37.72 28.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.21 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 61.72 40.68 12.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.911 0.386 . . . . 0.0 111.145 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -176.64 159.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.822 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.44 ' CD2' HG13 ' A' ' 70' ' ' ILE . 29.9 p-80 -85.17 117.93 24.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.026 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.883 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 77.9 m95 -106.93 122.92 47.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.608 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.482 ' CE1' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.98 151.84 11.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.894 -179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -59.01 -35.89 74.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.843 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mttt -91.15 -48.9 6.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.94 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 21.0 m -58.48 -27.95 64.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.117 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.667 HD21 HG21 ' A' ' 28' ' ' ILE . 54.6 tp -72.17 88.79 1.14 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 96' ' ' PRO . 24.3 mmtt -134.96 159.29 41.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.888 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 53.3 t -60.75 147.03 43.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.79 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -62.59 -39.91 95.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.506 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -99.7 -63.12 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.434 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 34.2 m -56.36 -33.23 65.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.314 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 53.68 24.98 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.026 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 4.2 m -86.03 161.51 49.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.261 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' HA ' ' HD3' ' A' ' 89' ' ' LYS . 51.2 Cg_exo -54.18 118.96 5.58 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.594 2.196 . . . . 0.0 112.309 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 mp -126.83 74.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.809 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -116.64 30.98 7.01 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.067 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -137.43 -55.04 0.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.451 ' HB2' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.71 135.07 47.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.933 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.839 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.6 t -113.02 163.87 14.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.834 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.9 t80 -165.32 120.95 1.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 90.1 p -151.98 172.35 16.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -167.43 123.99 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.5 -87.1 1.31 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.471 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -150.77 36.25 0.63 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.883 0.373 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.7 m -156.23 142.5 18.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.938 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 102' ' ' PHE . 12.1 p -112.6 115.98 51.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.461 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.3 OUTLIER -130.08 121.03 25.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.84 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.0 p -49.63 173.29 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.224 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 11.7 mtpt -78.16 -28.79 48.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.452 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.4 t70 -52.91 -52.91 56.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.264 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -84.05 -20.7 32.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.277 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.484 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 14.4 t80 -61.48 -33.3 73.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.0 110.758 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.6 m-85 -59.71 -45.34 92.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.77 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -74.68 -27.02 60.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.005 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.8 mtt-85 -64.2 -54.99 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.223 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -117.03 -42.99 2.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -56.93 171.89 2.46 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -58.93 149.22 27.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.789 0.328 . . . . 0.0 110.931 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -150.88 162.13 41.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.891 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 16.1 t -79.0 155.8 28.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.953 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -111.09 -20.56 12.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.363 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.485 ' HB2' ' CD2' ' A' ' 143' ' ' TYR . . . -78.22 -58.03 3.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.05 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.26 -12.08 21.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.186 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 62.88 36.75 12.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.808 0.337 . . . . 0.0 111.014 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.5 tp -109.49 144.17 38.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.796 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -62.44 104.25 0.74 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.553 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.771 ' CD1' HG13 ' A' ' 142' ' ' VAL . 64.8 mt -61.42 140.38 94.75 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.638 0.256 . . . . 0.0 110.987 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.568 ' CB ' ' HG2' ' A' ' 133' ' ' GLN . 83.8 Cg_exo -43.97 170.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.874 2.383 . . . . 0.0 112.814 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.35 -55.58 0.05 OUTLIER 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.479 2.12 . . . . 0.0 114.831 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.857 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.63 21.48 7.07 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -177.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 84.2 mm-40 -59.57 -178.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.791 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.604 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -122.52 114.35 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.071 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.564 HG22 ' N ' ' A' ' 136' ' ' ARG . 11.4 p -157.05 164.56 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 -179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.564 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -95.8 137.68 34.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.889 0.376 . . . . 0.0 110.346 179.912 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.519 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.61 133.52 49.33 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.018 -179.267 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.632 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -67.96 96.31 0.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.761 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 39.97 -89.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' ALA . 1.4 t70 -80.64 -39.53 27.19 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.377 -177.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.405 ' O ' ' N ' ' A' ' 138' ' ' ALA . 2.9 m-85 -106.65 173.35 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.852 -178.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.771 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.9 p -126.65 149.0 31.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.604 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.632 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 3.6 m-85 -131.88 158.88 40.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 111.364 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 76.7 m80 -71.53 137.92 48.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.042 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.54 -17.79 60.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -84.33 -37.37 21.7 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.393 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 7.7 p -96.43 -19.05 19.46 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.73 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 4.8 t80 -60.1 119.53 8.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.708 0.29 . . . . 0.0 110.804 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.02 -176.87 1.77 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.207 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -84.67 150.06 25.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.976 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 5.4 m -68.98 -30.16 45.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.143 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -109.48 -52.61 6.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.173 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 13.8 m -66.04 -28.1 68.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.005 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 2.5 tttt 58.01 34.58 24.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.995 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -115.47 137.33 52.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.925 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.449 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.7 mt-30 -64.63 155.25 33.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.025 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.693 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.1 mm? -115.44 164.25 14.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.682 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.406 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.08 169.34 18.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.418 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 m -42.79 122.19 2.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.71 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.24 -22.87 36.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.724 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.443 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.9 t70 -64.35 128.88 37.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.744 0.307 . . . . 0.0 110.774 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 53.6 mt-10 -91.31 115.35 27.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.942 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.747 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -137.44 169.26 18.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.021 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.531 ' HB2' HG13 ' A' ' 172' ' ' VAL . 87.2 m-85 -115.51 171.01 7.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.737 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.628 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.9 OUTLIER -124.93 116.45 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.821 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.0 mtp -72.26 -176.24 1.77 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.976 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -83.01 -26.22 31.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.18 30.33 2.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.049 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 12.9 p 58.32 45.35 17.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.025 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.06 155.3 19.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -105.06 123.47 47.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.939 -179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.531 HG13 ' HB2' ' A' ' 164' ' ' TYR . 8.9 p -142.54 125.26 13.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.06 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 23.3 p -78.53 -171.0 2.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.951 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 13.2 mttt -79.1 -30.18 43.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.149 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.55 -34.94 79.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.389 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 8.8 p30 -104.14 4.11 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.594 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 8.8 t80 -65.93 -66.12 0.59 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.831 0.348 . . . . 0.0 110.778 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -59.12 -26.06 64.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.032 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.5 m -72.98 -27.69 61.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.093 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.35 -32.12 12.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.914 0.387 . . . . 0.0 110.738 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . 0.446 ' HE3' ' CZ ' ' A' ' 177' ' ' TYR . 0.0 OUTLIER 179.29 171.54 0.93 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.929 -179.877 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.876 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.896 0.379 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 t -170.8 -171.14 0.97 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.009 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.3 tp60 -71.43 146.3 48.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.92 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.717 HG23 ' OD1' ' A' ' 6' ' ' ASP . 6.2 m -101.81 150.33 37.27 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.101 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -51.73 -27.37 26.39 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.585 2.19 . . . . 0.0 112.375 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.717 ' OD1' HG23 ' A' ' 4' ' ' VAL . 7.2 m-20 61.24 101.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.442 HG22 ' N ' ' A' ' 8' ' ' MET . 12.8 p -96.91 155.64 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.195 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.576 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -154.98 -173.12 4.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.627 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.412 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.0 p -155.06 144.8 13.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.223 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.493 HG22 ' CE1' ' A' ' 163' ' ' PHE . 32.6 t -67.79 146.2 13.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.688 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -129.92 -176.18 14.33 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.629 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 3.6 mm-40 -59.85 148.2 76.95 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-O 120.573 0.225 . . . . 0.0 110.775 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.837 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.6 Cg_exo -77.92 137.02 15.38 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.642 2.228 . . . . 0.0 112.586 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.6 OUTLIER -166.01 142.85 5.25 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.985 179.848 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.807 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -120.53 173.6 7.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.202 0.525 . . . . 0.0 111.445 -179.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.567 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -71.17 -28.84 64.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.017 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.957 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 58.72 56.28 26.16 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.304 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.52 -50.17 70.68 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.6 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 70.08 -64.81 0.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.737 0.303 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.48 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER 62.85 163.14 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.907 -179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.46 -170.94 44.1 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.577 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -59.19 -28.47 66.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 0.0 111.078 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -56.64 -29.47 62.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.09 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.52 -75.28 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' CG ' ' CE2' ' A' ' 102' ' ' PHE . 52.4 mm-40 -113.57 172.83 6.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.845 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 ptp85 -76.04 144.49 40.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.878 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.673 HD21 ' HG2' ' A' ' 100' ' ' ARG . 1.5 tp -111.99 163.68 13.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.837 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.819 ' HA ' ' HB2' ' A' ' 78' ' ' ALA . 4.6 pt -62.93 161.83 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.176 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.8 m -130.81 106.85 8.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.803 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.3 101.8 7.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.534 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -142.62 150.36 40.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.053 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.431 ' HG3' ' CD1' ' A' ' 74' ' ' PHE . 2.8 mt-10 -68.48 157.06 36.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.439 ' O ' HG22 ' A' ' 34' ' ' THR . 2.4 m120 -123.7 19.5 9.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.226 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 33' ' ' ASN . 13.6 t 43.95 31.21 0.48 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.382 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -120.24 162.3 19.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -177.14 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.831 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -114.04 107.3 15.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.956 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.576 ' HB3' HD22 ' A' ' 71' ' ' LEU . . . -169.29 120.42 0.71 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.076 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 62.79 18.35 10.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.449 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.5 m120 61.63 81.53 0.19 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.87 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.7 -83.72 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.513 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.641 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.5 mp -84.25 -55.76 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -105.98 174.52 5.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.91 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -133.04 122.52 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.929 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.76 105.19 15.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.903 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.54 -61.51 0.21 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.482 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.04 28.54 9.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.491 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.39 141.07 45.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.848 0.356 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.86 97.41 1.35 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.493 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.91 28.73 5.8 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.445 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 84.84 1.59 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.346 . . . . 0.0 110.874 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.3 mtt -137.76 35.06 2.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.07 -33.15 0.15 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.539 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -60.31 -70.63 0.16 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.872 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -86.58 126.87 8.09 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.545 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -174.3 161.05 30.93 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.511 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.89 86.93 2.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 120.727 0.299 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -69.38 161.35 46.23 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.497 2.132 . . . . 0.0 112.246 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 60.2 33.84 21.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.714 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.6 tp -108.94 134.63 20.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.001 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.453 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.8 Cg_endo -60.17 125.99 19.0 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.435 2.09 . . . . 0.0 112.119 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.38 140.51 30.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.107 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.0 p -58.07 164.2 2.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.975 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.456 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.46 114.59 23.35 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.515 179.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.83 -69.81 0.46 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.6 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.1 p -105.25 153.77 21.14 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.818 0.342 . . . . 0.0 110.985 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -74.52 87.13 2.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.21 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -179.22 133.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.714 ' CD2' HG21 ' A' ' 60' ' ' ILE . 12.6 p80 -72.1 143.62 48.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 84' ' ' HIS . 4.9 mm -70.76 152.08 8.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.851 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.576 HD22 ' HB3' ' A' ' 38' ' ' ALA . 0.7 OUTLIER -174.21 35.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.91 -179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -107.53 162.84 13.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.925 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -59.64 -74.04 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.431 ' CD1' ' HG3' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -82.91 120.87 26.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.021 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.32 146.68 28.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.205 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.7 106.67 17.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.435 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 2.3 tttm -91.48 127.61 36.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.953 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.819 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -166.68 165.24 16.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.188 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.804 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.2 mt 59.25 37.25 23.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.109 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 61.83 29.52 17.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.014 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -169.89 -179.15 3.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.924 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.403 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 25.9 p-80 -97.2 124.63 41.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.87 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.804 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.4 m95 -115.77 130.58 56.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.718 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.564 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.99 170.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.909 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 p -80.02 -40.07 28.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 34.0 mttm -90.57 -26.85 19.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.042 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 68.4 m -71.06 -30.27 66.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.971 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.65 HD11 ' SG ' ' A' ' 101' ' ' CYS . 18.4 tp -76.6 80.3 3.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.852 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -135.94 153.18 51.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.875 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.71 135.48 48.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.766 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.02 -29.21 68.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.063 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.24 -62.92 1.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.146 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.422 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.9 m -58.28 -34.98 71.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 55.33 23.72 5.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.112 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.422 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.5 m -85.97 156.37 57.9 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.216 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.55 118.95 5.92 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.497 2.131 . . . . 0.0 112.308 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.506 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.0 mp -104.02 65.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.818 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -98.05 30.25 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.111 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.797 ' C ' HD11 ' A' ' 28' ' ' ILE . 2.1 mm-40 -140.26 -51.94 0.49 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.673 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -132.25 174.36 10.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.74 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.2 t -157.01 141.6 16.75 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.449 ' CE2' ' CG ' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -133.98 172.04 13.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.81 179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -147.61 155.26 41.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.878 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -170.28 124.04 0.71 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.874 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 70.23 -90.62 0.36 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.444 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -153.87 36.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.847 0.356 . . . . 0.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 7.0 m -153.21 153.08 32.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.3 p -85.71 116.02 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.041 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.04 160.19 20.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -97.98 171.22 8.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.743 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.415 ' HE3' ' CZ ' ' A' ' 102' ' ' PHE . 1.5 mttt -78.16 -32.9 50.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.477 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.5 -58.08 7.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.543 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.9 p30 -72.92 -20.83 61.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.48 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 4.4 t80 -64.38 -33.55 76.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.859 0.361 . . . . 0.0 110.953 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 4.9 m-85 -79.15 -35.24 42.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.01 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt -84.96 -59.05 2.45 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.284 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -71.54 -47.36 55.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.387 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -98.07 37.03 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.857 0.361 . . . . 0.0 111.064 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -149.06 -178.95 24.54 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.36 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.567 HG21 ' SD ' ' A' ' 16' ' ' MET . 72.4 m -60.11 153.53 21.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.752 0.31 . . . . 0.0 110.794 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.4 ttpp -144.44 174.27 11.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.126 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.734 ' HB2' HD11 ' A' ' 129' ' ' ILE . 41.8 t -93.4 130.76 39.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.799 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.456 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.81 29.53 3.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.111 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.687 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . . . -125.12 -53.27 1.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.26 -8.34 14.37 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.323 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 64.07 64.73 0.73 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.934 0.397 . . . . 0.0 110.905 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 127' ' ' LEU . 5.2 tp -134.63 175.77 9.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -99.15 99.15 2.08 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.718 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.734 HD11 ' HB2' ' A' ' 122' ' ' CYS . 1.7 mp -74.45 138.14 74.6 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.424 0.154 . . . . 0.0 110.692 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.631 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 89.6 Cg_exo -44.4 173.2 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.596 2.197 . . . . 0.0 112.59 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.69 -55.1 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.861 2.374 . . . . 0.0 113.814 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.957 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -120.23 21.72 11.63 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.226 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.631 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.6 OUTLIER -67.95 137.55 55.25 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.584 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.837 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -74.14 108.77 5.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.953 0.406 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.807 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.3 p -143.08 158.29 17.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.773 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.41 134.81 39.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.893 0.378 . . . . 0.0 110.777 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -104.96 112.92 26.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.893 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.453 ' HB1' ' OE1' ' A' ' 139' ' ' GLN . . . -79.82 146.92 32.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.795 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.453 ' OE1' ' HB1' ' A' ' 138' ' ' ALA . 18.0 pm0 42.64 -142.28 0.11 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.334 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -89.74 35.26 0.83 Allowed 'General case' 0 CA--C 1.528 0.099 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.456 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 33.0 m-85 -151.41 169.0 23.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.914 0.388 . . . . 0.0 111.039 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.7 p -103.57 148.65 8.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.047 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.687 ' CZ ' ' HB2' ' A' ' 124' ' ' ALA . 6.9 m-85 -126.89 175.06 8.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.967 0.413 . . . . 0.0 111.21 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.458 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.8 m80 -104.95 136.85 43.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.648 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -55.75 -22.4 23.79 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 177.754 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.33 -36.0 14.1 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.674 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -97.14 1.65 50.18 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.458 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.5 t80 -86.03 115.84 23.88 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.777 0.323 . . . . 0.0 110.645 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.0 -176.95 1.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.259 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 34.5 t -96.54 150.21 20.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.025 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 152' ' ' VAL . 14.2 m -67.44 -27.29 38.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.289 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.637 HG23 HG23 ' A' ' 151' ' ' VAL . 28.3 t -104.11 -55.7 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.424 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 30.1 m -65.94 -28.04 68.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.981 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 1.4 mmtm 57.53 28.5 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.999 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 34.2 mtm180 -121.74 147.75 45.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.736 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.425 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.7 mt-30 -66.76 153.43 43.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.038 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.1 mm? -115.89 139.93 49.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.728 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -107.37 167.0 10.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.163 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 8.8 t -46.79 138.55 6.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.33 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.33 -32.59 6.77 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.499 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.412 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.5 m-20 -63.81 128.92 37.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.816 0.341 . . . . 0.0 110.766 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.404 ' HA ' HG23 ' A' ' 9' ' ' VAL . 11.7 mt-10 -93.7 116.18 28.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.994 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.65 ' CD2' HD23 ' A' ' 171' ' ' LEU . 13.8 p90 -126.91 166.28 17.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.917 179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 23.4 m-85 -117.27 171.17 8.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.144 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.496 HD21 ' O ' ' A' ' 168' ' ' ASP . 1.2 tp -124.38 111.02 15.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.429 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 2.8 mmt -60.94 -89.98 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.264 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -83.23 -49.16 9.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.802 0.334 . . . . 0.0 111.097 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . 0.496 ' O ' HD21 ' A' ' 165' ' ' LEU . 2.3 t0 176.82 -38.0 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.748 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 33.7 p -115.4 30.76 7.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.894 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.9 mtt180 -120.48 132.21 55.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.811 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.65 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.2 OUTLIER -103.84 123.69 47.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.837 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.512 ' O ' HG13 ' A' ' 172' ' ' VAL . 13.4 p -145.07 118.92 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.094 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 34.3 m -55.37 -176.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.015 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 27.0 mttm -69.31 -49.0 59.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.816 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.17 84.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.009 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -59.45 -25.95 64.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.937 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -54.54 -65.31 0.6 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.018 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -54.13 -23.49 14.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.304 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 63.0 m -87.07 -26.77 23.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.01 -52.07 4.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.487 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 171.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.927 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.856 -179.959 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.39 79.88 8.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.893 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.52 118.3 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.4 ' O ' HG23 ' A' ' 4' ' ' VAL . 5.2 m -59.96 109.87 2.34 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.135 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.02 -42.58 3.02 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.381 2.054 . . . . 0.0 112.298 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -156.52 115.85 3.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.976 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 11.0 p -125.93 158.72 34.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.092 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -146.1 -179.3 6.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.679 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.4 p -155.02 135.38 4.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.29 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.471 HG23 ' CD1' ' A' ' 163' ' ' PHE . 41.3 t -59.03 146.27 9.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.489 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -136.12 -159.75 8.57 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.743 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -59.33 123.27 69.35 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.514 0.197 . . . . 0.0 110.901 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.566 ' HB2' HG12 ' A' ' 134' ' ' VAL . 23.1 Cg_exo -62.03 138.42 72.96 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.309 2.006 . . . . 0.0 112.263 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -166.03 148.56 7.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.781 HD11 HG22 ' A' ' 129' ' ' ILE . 1.1 mt -116.84 173.4 6.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.294 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.437 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.58 -37.09 77.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.866 179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.9 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.44 81.54 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.543 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.84 -72.29 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.504 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 60.67 86.87 0.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.782 0.325 . . . . 0.0 110.826 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.524 ' CZ ' ' CE1' ' A' ' 115' ' ' PHE . 29.7 p90 -59.79 -44.47 93.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.036 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.436 ' N ' ' CD1' ' A' ' 20' ' ' PHE . . . 57.39 -120.91 23.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.563 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -83.94 -23.86 30.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.733 0.301 . . . . 0.0 111.168 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.99 -29.98 32.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.175 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.19 -73.55 0.39 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.874 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 19.9 tp10 -120.99 163.49 18.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 147.87 38.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.884 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.676 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.3 mm? -101.58 165.13 11.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.972 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.875 HG21 HD21 ' A' ' 88' ' ' LEU . 4.1 pt -62.97 144.01 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.147 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.6 m -110.29 106.85 16.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.768 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.28 101.83 10.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.552 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.512 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.35 157.16 44.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.996 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -87.04 157.05 19.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -110.83 -178.09 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 p -120.64 37.22 4.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.895 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -90.42 -54.03 4.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.967 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.0 t80 68.5 -68.1 0.18 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.917 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.9 -65.26 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.07 -79.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.211 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.24 17.41 2.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.919 0.39 . . . . 0.0 111.434 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -176.64 141.83 0.4 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.909 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.426 ' H ' HD12 ' A' ' 42' ' ' ILE . . . 147.97 45.61 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.481 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.64 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.5 mp -84.24 -72.37 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 110.866 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -132.1 -177.1 4.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.939 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.47 87.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -83.54 108.73 16.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.882 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -140.96 113.89 0.89 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.496 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 101.25 -95.74 1.42 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.51 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 m -158.24 102.93 1.79 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.869 0.366 . . . . 0.0 110.858 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 153.1 49.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.495 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.18 32.99 2.36 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.534 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -132.17 82.37 2.01 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.895 0.379 . . . . 0.0 110.911 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -69.32 -60.87 2.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -172.12 47.34 0.18 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.548 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -156.15 172.1 19.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.787 0.327 . . . . 0.0 110.95 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 101.51 -174.64 24.98 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.458 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.27 93.39 1.03 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.487 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.98 87.41 51.77 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.767 0.318 . . . . 0.0 110.888 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -51.72 164.7 0.91 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.554 2.169 . . . . 0.0 112.293 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 59.31 31.2 20.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.847 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.563 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -109.79 135.0 20.46 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.445 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.0 Cg_endo -60.56 125.95 18.66 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.379 2.053 . . . . 0.0 112.144 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.54 139.34 30.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.041 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 13.9 p -57.73 164.22 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.933 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.3 114.67 23.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.44 179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 123.45 -75.04 0.38 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.607 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.2 p -98.78 152.33 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 110.941 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 87.25 1.87 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.02 136.85 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.563 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.5 p80 -73.76 151.48 40.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.972 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.541 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -79.69 153.51 4.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.908 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.403 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.6 OUTLIER -173.41 35.76 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.899 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -109.3 163.05 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -77.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -77.42 120.57 22.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 44.9 mm -122.83 154.02 27.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.205 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 7.6 mp -112.2 106.83 15.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.369 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -90.85 129.39 36.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.967 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -161.41 162.78 30.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.182 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.658 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 55.01 36.13 26.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.14 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 62.5 30.19 17.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.012 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -164.03 170.11 17.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.954 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.411 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 30.8 p-80 -88.38 120.94 30.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.898 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.682 ' CB ' HD13 ' A' ' 88' ' ' LEU . 47.4 m95 -110.17 130.04 55.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.541 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -55.54 174.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.7 t -79.99 -42.17 24.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -90.35 -29.75 17.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.956 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 93.6 m -69.63 -31.41 69.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.911 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.875 HD21 HG21 ' A' ' 28' ' ' ILE . 7.3 tp -72.82 77.52 1.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -137.05 165.46 25.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.809 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.59 147.07 39.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.869 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -28.49 67.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.013 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -111.49 -57.24 2.28 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.101 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 26.9 m -57.76 -46.1 85.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.067 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 94' ' ' HIS . 10.5 t-160 58.31 21.7 8.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.138 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.538 ' O ' HD13 ' A' ' 97' ' ' LEU . 13.3 m -86.47 155.69 56.74 Favored Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.118 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 118.98 5.95 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.495 2.13 . . . . 0.0 112.081 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.605 ' O ' HD23 ' A' ' 88' ' ' LEU . 7.4 mp -107.59 64.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.805 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -100.04 30.66 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.112 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.78 ' N ' HD11 ' A' ' 28' ' ' ILE . 15.3 mm-40 -138.48 -47.23 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.893 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.676 ' CB ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -153.58 148.12 26.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.816 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.634 ' HB2' HG23 ' A' ' 28' ' ' ILE . 4.5 t -143.2 128.24 18.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.966 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.438 ' CD1' ' HG3' ' A' ' 111' ' ' LYS . 0.6 OUTLIER -111.52 172.03 7.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.807 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 p -152.24 122.72 7.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.946 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -136.13 124.06 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 80.13 -102.02 2.01 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.495 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -143.56 34.92 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -153.33 152.46 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.891 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.436 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.9 p -77.98 124.47 36.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -121.01 143.31 49.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.002 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 30.0 p -87.91 153.54 21.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.438 ' HG3' ' CD1' ' A' ' 102' ' ' PHE . 29.6 mtpt -56.21 -34.69 66.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.927 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.403 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 5.5 t0 -63.43 -28.05 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.998 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -83.91 -22.95 31.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.202 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.516 ' CD1' ' CE2' ' A' ' 20' ' ' PHE . 8.8 t80 -73.86 -49.81 23.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.029 -179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.524 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 m-85 -51.88 -40.23 60.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.853 0.359 . . . . 0.0 111.239 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -85.07 -64.11 1.21 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.465 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -59.91 -49.27 78.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.58 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -109.26 37.02 2.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -164.39 168.1 38.6 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.6 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' HG11 ' A' ' 142' ' ' VAL . 85.8 m -61.55 154.99 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.69 0.281 . . . . 0.0 110.659 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -162.11 161.15 28.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 111.168 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.02 137.27 56.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.84 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -97.6 29.76 3.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -58.18 1.47 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.292 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 17.1 p -110.85 8.15 22.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.46 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 59.51 29.44 19.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.697 0.284 . . . . 0.0 111.069 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.3 tp -92.18 121.69 33.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.48 112.08 3.42 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.763 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.781 HG22 HD11 ' A' ' 15' ' ' LEU . 4.2 mt -71.77 132.92 84.71 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 110.551 -0.166 . . . . 0.0 110.551 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 76.1 Cg_exo -47.37 176.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.297 1.998 . . . . 0.0 112.592 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.03 -52.13 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.113 2.542 . . . . 0.0 113.632 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.9 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.03 22.02 7.39 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -55.88 -169.94 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.678 179.762 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.806 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -120.14 108.81 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.889 0.376 . . . . 0.0 111.019 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.779 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.1 p -157.05 160.93 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.942 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.61 134.87 39.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.487 179.743 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.401 ' CB ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -112.14 135.87 52.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.878 -179.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.829 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -71.21 96.67 1.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.977 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.65 -88.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.359 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.422 ' N ' ' O ' ' A' ' 138' ' ' ALA . 3.2 t70 -90.55 -46.07 8.53 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.782 -177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.644 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.462 HG11 ' CG2' ' A' ' 120' ' ' THR . 10.5 p -117.1 150.61 19.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.679 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.484 ' O ' HG21 ' A' ' 135' ' ' VAL . 27.5 m-85 -132.16 174.95 9.67 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.443 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -79.43 165.24 23.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.913 -179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.806 HD21 ' O ' ' A' ' 134' ' ' VAL . 3.3 mp -81.07 -32.32 34.04 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -91.36 -49.29 6.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.727 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.443 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 69.3 m -53.55 -29.6 37.71 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.127 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.788 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.89 114.68 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.086 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.529 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.19 154.24 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.035 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 36.9 t -59.56 149.96 28.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.933 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 152' ' ' VAL . 5.1 m -63.9 -28.22 44.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.402 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.645 HG23 HG23 ' A' ' 151' ' ' VAL . 19.7 t -109.07 -56.7 4.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.338 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 31.7 m -65.92 -28.13 68.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.172 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.529 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 68.5 mttt 49.93 48.57 21.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.072 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -118.35 136.66 53.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.026 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.2 149.51 19.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.319 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.712 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.6 OUTLIER -114.9 162.26 17.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.499 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 172.56 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.26 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 3.5 m -45.43 125.34 5.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.398 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.87 -22.76 37.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.694 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.461 ' C ' HG23 ' A' ' 9' ' ' VAL . 10.1 t70 -62.19 128.9 38.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 110.765 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.432 ' HA ' HG23 ' A' ' 9' ' ' VAL . 56.5 mt-10 -87.98 123.42 32.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.94 0.4 . . . . 0.0 111.098 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.891 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -144.0 156.4 44.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.705 ' HB2' HG13 ' A' ' 172' ' ' VAL . 47.4 m-85 -108.62 171.1 7.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.772 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.829 HD11 ' HB1' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -125.31 121.34 33.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.853 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 6.7 mmt -81.6 166.97 19.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -65.86 -28.43 68.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -97.68 29.23 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.059 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.2 57.04 4.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.98 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.468 ' HB3' HG11 ' A' ' 151' ' ' VAL . 4.6 mtt180 -125.66 128.29 47.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' A' ' 163' ' ' PHE . 3.0 mp -78.6 133.29 37.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.705 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.5 p -145.06 137.27 21.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.935 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.6 p -81.56 169.13 17.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.903 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 25.8 mttt -59.13 -51.79 68.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.928 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -56.6 -25.47 52.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.293 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -96.81 -14.54 21.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.381 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.401 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 7.2 t80 -57.58 -66.0 0.54 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.371 . . . . 0.0 110.911 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.36 -28.49 70.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.139 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 2.9 m -75.33 -33.3 61.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.062 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -88.9 -49.58 6.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.216 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 6.8 mmmm 62.34 175.36 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.927 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.933 179.99 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.766 0.317 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.06 161.02 28.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.946 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -176.49 -40.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.857 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.661 HG21 HG12 ' A' ' 7' ' ' VAL . 12.2 m -87.49 148.66 44.81 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.074 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.12 -45.81 0.82 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.521 2.148 . . . . 0.0 112.286 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -176.43 78.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.661 HG12 HG21 ' A' ' 4' ' ' VAL . 13.2 p -100.53 158.89 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.164 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.498 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -157.21 -170.61 3.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.667 -179.826 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' C ' ' A' ' 161' ' ' ASP . 4.5 p -155.04 147.59 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.221 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.699 HG21 ' HB3' ' A' ' 157' ' ' LEU . 22.5 t -61.85 146.31 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.652 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.4 -163.54 10.49 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.521 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -73.69 130.04 84.26 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.449 0.166 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.892 ' HB2' HG12 ' A' ' 134' ' ' VAL . 25.2 Cg_exo -60.67 146.91 96.37 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.269 1.979 . . . . 0.0 112.399 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -163.13 160.56 24.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.465 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.754 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.2 OUTLIER -144.02 173.58 11.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.066 0.46 . . . . 0.0 111.36 -179.649 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -39.85 94.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.896 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 57.39 83.02 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.642 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.34 -126.01 3.24 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.32 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 170.51 -33.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 110.826 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 3.4 t80 69.18 161.67 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.869 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -111.02 127.14 8.1 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.627 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.575 ' OD1' HD11 ' A' ' 27' ' ' LEU . 9.5 t0 -84.05 -30.42 26.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.875 0.369 . . . . 0.0 110.936 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -58.07 -24.51 58.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.114 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -54.66 -30.13 54.49 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.06 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.446 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.9 OUTLIER -109.14 175.99 5.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.908 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.7 mmt85 -94.38 99.97 12.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.619 HD12 ' CB ' ' A' ' 100' ' ' ARG . 3.4 mm? -69.96 161.34 30.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.864 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.783 HG23 ' HB2' ' A' ' 101' ' ' CYS . 6.2 pt -62.99 138.52 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.129 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.2 m -100.52 106.84 18.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.2 mtm-85 -84.69 101.73 12.42 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.377 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -133.74 151.43 51.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.085 -179.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -74.88 96.97 3.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.903 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.408 ' OD1' HD13 ' A' ' 31' ' ' LEU . 1.8 m120 -68.34 116.15 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.3 t -65.59 79.22 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.904 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -151.8 78.99 1.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.873 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -96.02 -31.49 13.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.898 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -127.42 115.66 19.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.881 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -165.11 -43.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.125 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -169.27 107.1 0.41 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.068 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.24 34.99 20.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -84.34 -57.29 2.38 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.45 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.4 HG22 ' N ' ' A' ' 43' ' ' ASP . 42.2 mm -82.03 154.17 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.847 0.356 . . . . 0.0 110.917 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.4 ' N ' HG22 ' A' ' 42' ' ' ILE . 0.5 OUTLIER 60.55 157.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.36 157.73 16.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.878 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -99.17 117.2 33.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.927 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 164.58 55.26 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.454 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 178.43 -148.44 8.44 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.515 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 94.5 p -176.5 126.63 0.18 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 110.897 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -140.64 31.72 2.2 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.547 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 137.44 -111.04 0.8 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.49 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -105.5 -56.64 2.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.837 0.351 . . . . 0.0 110.899 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.6 mmt 60.54 176.81 0.1 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.903 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 137.53 -178.13 19.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.465 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.58 -67.79 0.44 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.772 0.32 . . . . 0.0 110.895 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 137.59 -150.3 20.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.518 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -145.04 151.62 23.77 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.44 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.07 86.12 55.34 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.688 0.28 . . . . 0.0 110.851 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.37 164.07 35.56 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.562 2.175 . . . . 0.0 112.209 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 59.08 31.61 21.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.857 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.624 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -106.56 134.7 19.69 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.112 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.438 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.9 Cg_endo -61.17 125.99 18.33 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.388 2.059 . . . . 0.0 112.084 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.9 139.81 30.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.069 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.7 p -57.54 164.14 2.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.958 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.42 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -86.31 114.61 23.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.481 179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.06 -71.36 0.44 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.601 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.8 p -103.56 152.94 21.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.774 0.321 . . . . 0.0 110.981 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -74.45 87.2 2.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.11 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -178.79 135.19 0.14 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.943 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.624 ' CD2' HG21 ' A' ' 60' ' ' ILE . 10.9 p80 -71.39 143.47 50.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.906 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 70' ' ' ILE . 3.4 mm -68.76 147.62 12.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.905 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.515 HD23 ' ND1' ' A' ' 69' ' ' HIS . 0.6 OUTLIER -173.7 35.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.929 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' HD11 ' A' ' 75' ' ' ILE . 2.0 m-20 -111.39 144.6 40.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.91 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -34.26 67.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.109 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.585 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.0 m-85 -106.19 112.03 24.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.585 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.6 mm -132.61 147.48 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -109.82 107.35 17.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.286 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -90.77 122.5 33.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.055 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.778 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -164.71 167.1 19.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.118 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD12 ' NE1' ' A' ' 83' ' ' TRP . 4.8 mt 62.95 37.04 12.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 29.18 17.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.065 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.5 mtt180 -170.62 -179.56 2.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 26.7 p-80 -97.99 124.45 42.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.972 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.776 ' CB ' HD13 ' A' ' 88' ' ' LEU . 42.2 m95 -116.54 130.8 56.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.779 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.452 ' CD2' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -54.71 172.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.1 p -79.57 -40.62 29.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.033 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -91.0 -28.47 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.54 -31.15 68.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.993 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.776 HD13 ' CB ' ' A' ' 83' ' ' TRP . 5.2 tp -80.86 94.38 6.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.976 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -144.07 156.77 44.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.837 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 23.7 t -60.0 147.13 40.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.805 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.3 m -74.21 -28.88 61.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.173 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -101.39 -63.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.135 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.468 ' HB2' HG22 ' A' ' 95' ' ' VAL . 37.2 m -60.07 -30.69 69.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.097 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 57.31 23.18 8.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.047 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.468 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.0 m -85.81 156.31 58.38 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.247 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.57 118.93 5.96 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.525 2.15 . . . . 0.0 112.297 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.8 mp -103.8 86.69 2.65 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.905 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -114.84 30.5 7.3 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.092 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.7 ' C ' HD11 ' A' ' 28' ' ' ILE . 41.2 mt-10 -140.03 -47.37 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.619 ' CB ' HD12 ' A' ' 27' ' ' LEU . 1.9 mpp_? -150.81 146.46 26.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.811 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.783 ' HB2' HG23 ' A' ' 28' ' ' ILE . 14.5 t -126.13 158.92 34.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.446 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.62 119.98 5.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.836 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.54 ' OG ' HD22 ' A' ' 79' ' ' LEU . 17.8 p -139.11 150.86 46.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.923 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.24 124.0 5.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.828 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -114.4 4.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.535 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -123.87 32.99 5.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.907 0.384 . . . . 0.0 110.928 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 26.2 m -157.69 166.89 31.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.863 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.5 p -129.33 115.98 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.077 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 109' ' ' TYR . 0.2 OUTLIER -131.7 132.42 43.89 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.866 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.4 p -52.06 167.02 0.13 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.424 ' HD2' ' CE1' ' A' ' 115' ' ' PHE . 1.7 mtmt -67.19 -30.43 70.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.973 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.429 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 4.8 t70 -55.2 -48.86 73.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -72.23 -20.9 61.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.051 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 118' ' ' PHE . 10.4 t80 -66.4 -41.05 89.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.951 0.405 . . . . 0.0 110.809 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.4 m-85 -67.77 -26.16 65.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.944 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.63 -43.81 25.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.21 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 118' ' ' PHE . 14.4 ptp180 -79.27 -47.24 16.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.382 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.49 ' CE2' ' CE2' ' A' ' 114' ' ' PHE . 76.3 m-85 -84.52 -43.02 14.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.99 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.94 167.89 40.57 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.574 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.8 m -59.58 152.93 20.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.6 172.24 14.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.069 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.2 t -63.77 138.57 58.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.869 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.71 29.53 2.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.995 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.22 -58.13 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.963 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 16.3 p -108.24 12.66 26.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.289 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 54.12 30.0 11.33 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.87 0.367 . . . . 0.0 111.083 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.403 HD23 ' CE1' ' A' ' 144' ' ' HIS . 18.6 tp -94.1 138.65 31.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.909 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -65.4 130.79 34.98 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.734 HG23 HE21 ' A' ' 133' ' ' GLN . 22.3 mt -87.0 126.82 61.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.435 0.159 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.636 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 86.0 Cg_exo -44.43 173.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.72 2.28 . . . . 0.0 112.706 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.87 -55.12 0.22 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.866 2.377 . . . . 0.0 113.684 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.896 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -126.2 21.42 7.36 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -178.296 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.734 HE21 HG23 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -59.02 138.54 57.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.388 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.892 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.0 OUTLIER -78.14 108.64 11.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.988 0.423 . . . . 0.0 110.891 -179.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.754 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.9 p -143.12 161.04 17.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.951 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.664 ' HD3' HD12 ' A' ' 145' ' ' LEU . 0.0 OUTLIER -96.78 134.98 39.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.929 0.395 . . . . 0.0 110.822 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.19 157.89 16.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.956 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.759 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -100.6 96.75 7.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.756 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.475 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.38 -86.52 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.497 0.665 . . . . 0.0 111.821 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -100.22 -48.97 4.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.783 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -82.59 161.78 22.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.628 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.471 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.6 p -106.31 151.28 8.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.672 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.521 ' O ' HG21 ' A' ' 135' ' ' VAL . 19.5 m-85 -129.68 174.97 9.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.036 0.446 . . . . 0.0 111.394 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -78.0 160.73 27.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.773 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.664 HD12 ' HD3' ' A' ' 136' ' ' ARG . 16.3 tp -81.03 -31.3 34.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.857 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -91.27 -49.28 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.913 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 74.3 m -53.35 -30.14 37.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.231 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.725 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 1.3 t80 -56.84 116.16 3.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.099 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.16 -177.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.926 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.0 t -99.88 150.04 22.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.62 HG11 ' HG2' ' A' ' 170' ' ' ARG . 6.0 m -65.91 -26.37 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.314 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.616 HG23 HG23 ' A' ' 151' ' ' VAL . 25.7 t -107.89 -55.76 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.371 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 24.6 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.01 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 53.9 34.98 20.65 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.159 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -124.68 143.93 50.48 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.933 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.435 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.3 mt-30 -59.01 154.06 16.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.699 ' HB3' HG21 ' A' ' 10' ' ' VAL . 1.6 mm? -111.77 123.05 49.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -99.25 158.18 15.87 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.04 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.7 t -44.84 132.48 6.62 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.534 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 106.81 -32.38 7.32 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.548 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.513 ' O ' HG23 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -71.02 133.61 46.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.845 0.355 . . . . 0.0 110.834 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -87.97 116.12 25.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.027 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.814 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.2 p90 -126.5 144.65 50.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.429 ' CE1' ' HA ' ' A' ' 7' ' ' VAL . 5.0 m-85 -96.97 147.39 24.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.775 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.759 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.3 tp -106.53 110.94 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.835 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.6 mmt -72.52 150.01 43.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -59.36 -28.76 67.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.012 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -97.48 36.2 1.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.996 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 3.1 p 49.97 83.6 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.184 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.62 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.7 OUTLIER -156.43 120.38 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.814 HD23 ' CD2' ' A' ' 163' ' ' PHE . 1.2 mp -80.12 126.5 31.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.815 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -145.09 127.87 10.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.014 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 52.6 m -58.34 -173.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.901 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.414 ' HE3' ' CE2' ' A' ' 164' ' ' TYR . 0.1 OUTLIER -72.8 -49.59 29.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -68.2 -44.12 76.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.119 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -58.81 -23.61 60.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.085 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -55.37 -65.97 0.5 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -57.46 -27.89 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.14 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 3.3 m -78.56 -30.44 46.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.065 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.88 16.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.257 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 8.6 mmmm 61.32 175.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.797 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.92 179.993 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.886 0.374 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.3 t -81.6 122.23 27.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.856 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.518 ' O ' HG13 ' A' ' 4' ' ' VAL . 4.9 pt20 -60.75 173.7 0.71 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.518 HG13 ' O ' ' A' ' 3' ' ' GLN . 6.1 m -158.88 87.0 2.25 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.051 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.96 143.75 50.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.561 2.174 . . . . 0.0 112.33 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -176.09 -171.62 0.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' HA ' ' CE1' ' A' ' 164' ' ' TYR . 12.6 p -58.37 142.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.895 0.378 . . . . 0.0 111.21 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.504 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -158.08 -175.87 5.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.527 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.463 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.0 p -155.03 131.82 2.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.185 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.473 HG23 ' CD1' ' A' ' 163' ' ' PHE . 57.8 t -55.71 146.3 5.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.667 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.501 ' C ' HG23 ' A' ' 159' ' ' THR . . . -127.5 -161.42 10.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.513 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -61.68 139.46 95.3 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.512 0.196 . . . . 0.0 110.759 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.3 Cg_exo -77.69 132.66 12.2 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.572 2.181 . . . . 0.0 112.193 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.02 155.74 25.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.63 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.2 mt -131.6 173.53 11.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.175 0.512 . . . . 0.0 111.525 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.527 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -62.6 -32.14 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.745 179.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.958 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 56.59 58.57 13.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.531 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -91.49 -75.34 1.3 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.563 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 65.56 77.17 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.919 0.39 . . . . 0.0 110.776 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.478 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.8 OUTLIER -57.89 -170.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.968 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 173.65 -163.28 34.46 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.541 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -84.0 -31.84 25.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.753 0.311 . . . . 0.0 110.903 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -59.58 -26.75 65.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.051 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.23 -76.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.03 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.444 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 13.0 mm-40 -103.28 175.25 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.966 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -84.15 134.32 34.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.857 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.693 HD12 ' HB3' ' A' ' 100' ' ' ARG . 3.0 mm? -95.43 165.01 12.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.969 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.691 HG23 ' HB2' ' A' ' 101' ' ' CYS . 9.4 pt -62.91 134.91 27.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.166 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 59.1 m -95.16 106.89 18.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.967 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.21 101.76 6.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.414 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -143.07 154.19 43.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.003 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -79.01 156.99 28.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -115.25 116.62 28.62 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.537 ' O ' HG23 ' A' ' 34' ' ' THR . 6.5 t -75.19 89.52 2.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.891 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.07 -73.43 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 68.13 -69.84 0.14 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.994 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.28 107.65 5.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.958 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.69 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -172.79 93.08 0.11 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.07 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.15 -171.29 0.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.061 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -60.42 94.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.862 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -104.15 -98.69 2.52 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 tp -54.6 144.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.816 0.341 . . . . 0.0 111.408 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -70.59 117.73 12.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.925 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -148.87 -47.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.842 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -77.66 127.69 32.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.871 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -101.49 56.99 0.69 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.527 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.55 -137.08 13.18 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.0 p -155.91 160.68 40.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -157.08 -46.91 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.462 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.98 89.72 0.18 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.511 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -153.07 98.77 2.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.866 0.365 . . . . 0.0 110.881 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.5 31.32 3.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -166.41 109.88 0.38 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.575 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.0 p -157.66 156.4 31.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.82 0.343 . . . . 0.0 110.919 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -172.05 114.85 0.54 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.477 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -59.67 -160.75 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.49 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.94 89.46 2.4 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.647 0.26 . . . . 0.0 110.895 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.27 165.14 27.79 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.489 2.126 . . . . 0.0 112.146 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 58.66 30.03 19.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.794 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.508 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -103.57 135.33 19.39 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.966 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.431 ' HD2' HD12 ' A' ' 60' ' ' ILE . 18.1 Cg_endo -60.92 125.96 18.43 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.35 2.034 . . . . 0.0 112.062 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.99 163.55 22.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.088 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 17.3 t -73.82 154.71 39.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.575 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.55 114.65 21.1 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.498 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.65 -50.03 0.81 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.453 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.5 p -108.64 -179.0 3.74 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.815 0.34 . . . . 0.0 110.847 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 p-10 -108.0 75.62 1.01 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.012 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -179.25 132.5 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.508 ' CD2' HG21 ' A' ' 60' ' ' ILE . 9.3 p80 -63.85 134.84 55.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.963 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.491 HD13 ' HA ' ' A' ' 70' ' ' ILE . 4.7 mm -59.65 151.54 5.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.937 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.69 HD22 ' O ' ' A' ' 38' ' ' ALA . 0.6 OUTLIER -174.58 36.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.873 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -107.16 158.23 17.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.888 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -60.13 -74.01 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.6 121.15 24.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.995 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.2 mm -124.86 151.49 30.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.205 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 mp -109.74 106.98 16.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.392 179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -90.75 124.38 35.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.026 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.635 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -159.04 159.9 35.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.13 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.834 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.9 OUTLIER 58.31 36.44 25.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.072 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.44 32.7 16.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.04 179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 mtm-85 -170.02 169.93 7.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.447 ' CD2' HG13 ' A' ' 70' ' ' ILE . 21.4 p-80 -86.42 127.41 34.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.928 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.623 ' CB ' HD13 ' A' ' 88' ' ' LEU . 53.5 m95 -119.81 123.71 44.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.8 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.78 172.94 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.992 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.4 t -77.11 -47.8 19.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.855 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 11.1 ttmt -85.91 -25.81 25.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.99 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 84.5 m -73.82 -28.2 61.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.953 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.775 HD23 ' O ' ' A' ' 97' ' ' LEU . 15.9 tp -80.79 90.17 5.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.002 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -143.71 154.83 43.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.823 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 8.4 t -59.85 147.06 39.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.847 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.4 m -73.51 -28.78 62.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.154 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -101.43 -63.05 1.18 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.189 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.525 ' HB2' HG22 ' A' ' 95' ' ' VAL . 30.0 m -59.83 -29.8 68.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.106 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.66 22.72 8.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.015 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.525 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.2 m -84.81 156.47 61.2 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.138 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.69 118.98 5.92 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.534 2.156 . . . . 0.0 112.366 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.775 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.1 mp -104.88 61.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.828 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -96.32 40.51 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.129 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.575 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.9 mm-40 -151.7 -46.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.809 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.693 ' HB3' HD12 ' A' ' 27' ' ' LEU . 40.6 mtm180 -148.23 143.61 27.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.725 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.834 ' SG ' HD21 ' A' ' 79' ' ' LEU . 51.3 t -119.16 156.05 30.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.99 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.444 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 1.9 t80 -154.82 119.97 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.775 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.408 ' HB2' HD22 ' A' ' 79' ' ' LEU . 1.2 t -96.73 160.53 14.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.448 ' CD ' ' CE2' ' A' ' 118' ' ' PHE . 0.0 OUTLIER -164.67 123.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 59.52 -131.86 51.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -98.85 31.62 2.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.885 0.374 . . . . 0.0 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.3 m -162.66 173.73 13.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.797 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.546 ' O ' HG13 ' A' ' 108' ' ' VAL . 13.8 p -102.15 115.86 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.129 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -121.35 120.94 36.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.857 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 31.1 p -60.33 172.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.898 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.439 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.13 -32.19 50.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.23 -179.773 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.443 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -51.74 -57.99 7.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.424 -179.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -74.15 -20.67 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.254 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.478 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 10.0 t80 -62.19 -26.36 68.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.94 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.443 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 3.7 m-85 -78.97 -39.61 33.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.036 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -85.04 -51.03 6.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.253 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 13.4 mmt85 -73.35 -51.35 17.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.448 ' CE2' ' CD ' ' A' ' 104' ' ' ARG . 5.1 m-85 -102.79 37.04 2.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.108 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.65 162.96 32.84 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.449 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.48 ' CG2' HG11 ' A' ' 142' ' ' VAL . 74.8 m -58.76 152.16 19.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.761 0.315 . . . . 0.0 110.959 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 126' ' ' GLN . 0.1 OUTLIER -169.01 147.88 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.896 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.449 ' N ' HD11 ' A' ' 129' ' ' ILE . 38.0 t -65.44 130.84 44.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.922 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -95.67 23.45 6.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.14 -41.61 2.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.978 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.9 m -106.94 -12.9 15.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.293 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 121' ' ' LYS . 0.0 OUTLIER 63.95 30.27 14.23 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 0.0 110.784 -179.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.411 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 1.9 tp -106.61 137.65 44.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.827 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.61 102.28 0.8 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.646 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.485 ' CD1' HG13 ' A' ' 142' ' ' VAL . 6.7 mt -60.26 140.38 91.39 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.493 0.187 . . . . 0.0 110.801 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.626 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 84.1 Cg_exo -47.34 173.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.468 2.112 . . . . 0.0 112.31 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -77.39 -54.97 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.47 2.113 . . . . 0.0 113.85 -179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.958 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -121.88 21.59 10.63 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.249 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.626 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 2.1 pt20 -59.02 140.01 56.21 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.512 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.732 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -80.12 108.74 13.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.934 0.397 . . . . 0.0 110.727 -179.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.63 HG12 ' HG ' ' A' ' 15' ' ' LEU . 9.2 p -154.64 158.91 3.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.218 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -96.91 137.98 35.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.653 179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.85 131.09 54.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.768 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.583 ' HB3' ' HE1' ' A' ' 143' ' ' TYR . . . -59.76 96.53 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.662 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.506 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.5 OUTLIER 54.03 -86.47 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.391 0.615 . . . . 0.0 111.61 -179.69 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.425 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.9 m-20 -99.42 -48.47 4.77 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -80.63 166.59 20.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.585 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.485 HG13 ' CD1' ' A' ' 129' ' ' ILE . 8.7 p -127.15 157.24 38.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.647 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.583 ' HE1' ' HB3' ' A' ' 138' ' ' ALA . 22.7 m-85 -153.58 161.79 41.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.4 . . . . 0.0 111.324 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 77.0 m80 -60.62 145.4 49.15 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.308 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.511 ' CD2' HG23 ' A' ' 135' ' ' VAL . 0.3 OUTLIER -66.76 -17.95 65.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -81.94 -49.02 10.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.946 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 15.1 p -81.06 -29.87 34.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.172 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.672 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 20.0 t80 -63.08 99.07 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.84 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.553 ' HB1' ' O ' ' A' ' 155' ' ' ARG . . . -162.0 175.28 11.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.098 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 47.1 t -78.72 150.21 32.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.023 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.723 HG11 ' NH1' ' A' ' 170' ' ' ARG . 34.5 m -72.26 -39.82 64.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.419 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.704 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -83.45 -57.23 4.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.549 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 35.2 m -65.89 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.9 34.36 23.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.943 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . 0.553 ' O ' ' HB1' ' A' ' 149' ' ' ALA . 54.0 mtm-85 -128.98 151.41 49.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.953 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -75.71 150.42 37.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.948 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.694 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.2 mm? -100.88 171.49 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.811 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.03 167.18 23.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.938 0.399 . . . . 0.0 111.275 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.501 HG23 ' C ' ' A' ' 11' ' ' GLY . 6.2 m -43.27 129.14 4.85 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.644 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.19 -22.94 33.95 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.828 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.463 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.8 t0 -67.94 129.03 38.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.86 0.362 . . . . 0.0 110.81 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.427 ' HA ' HG23 ' A' ' 9' ' ' VAL . 32.2 mt-10 -88.02 123.64 32.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.033 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.58 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.3 p90 -141.45 162.39 35.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.072 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.539 ' HB2' HG13 ' A' ' 172' ' ' VAL . 50.9 m-85 -110.93 171.03 7.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.908 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.506 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.1 tp -131.77 110.97 11.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.539 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.9 mmt -73.53 -89.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.137 -179.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -83.2 -49.2 9.69 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.84 0.352 . . . . 0.0 110.963 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -173.91 -59.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.675 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.411 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . 32.8 t -93.3 -22.99 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.723 ' NH1' HG11 ' A' ' 151' ' ' VAL . 2.9 mmm180 -56.41 102.39 0.08 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.13 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.672 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -91.51 125.77 36.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.826 179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.656 HG23 ' OD2' ' A' ' 176' ' ' ASP . 11.8 p -145.03 123.36 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.066 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 5.1 m -66.76 -172.44 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.056 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.423 ' HG2' ' CE2' ' A' ' 164' ' ' TYR . 1.4 mtpm? -86.08 -35.99 19.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.776 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -61.75 -51.59 67.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.091 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.704 ' HB2' HG21 ' A' ' 152' ' ' VAL . 3.8 p-10 -85.07 4.09 35.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.457 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.509 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 21.7 t80 -62.01 -65.98 0.61 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.059 0.457 . . . . 0.0 110.978 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -47.02 -28.63 1.74 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.492 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.26 -30.57 57.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.975 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.06 -20.78 17.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.526 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.46 -178.94 0.13 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.919 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.816 -179.985 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.8 p . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.831 0.348 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 p -66.36 131.5 46.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.87 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -131.31 123.25 27.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.907 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.56 HG12 ' CG1' ' A' ' 7' ' ' VAL . 12.3 m -154.75 84.18 3.84 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.095 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.71 -43.3 1.93 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.589 2.193 . . . . 0.0 112.293 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -157.55 54.26 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.618 HG11 ' HE2' ' A' ' 174' ' ' LYS . 14.6 p -124.45 159.48 30.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.256 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.491 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -109.27 -165.37 1.01 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.363 179.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.536 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.4 p -155.06 144.7 13.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.856 0.36 . . . . 0.0 111.369 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.445 HG13 ' HG3' ' A' ' 136' ' ' ARG . 47.8 t -62.06 146.1 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.169 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.68 -159.37 10.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.949 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -68.2 132.83 91.64 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.481 0.181 . . . . 0.0 110.9 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -65.25 145.15 83.25 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.343 2.029 . . . . 0.0 112.567 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.06 142.97 5.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.226 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.7 OUTLIER -124.22 173.67 8.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.942 0.401 . . . . 0.0 111.28 -179.544 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.732 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -72.04 -39.17 69.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.132 -179.823 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 132' ' ' THR . . . 53.04 82.32 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.6 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -121.31 -51.31 0.25 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.532 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 62.45 -176.09 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.799 0.333 . . . . 0.0 110.8 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.487 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -156.42 -75.07 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.927 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.64 144.73 14.68 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.596 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.512 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.8 p-10 -82.41 -30.97 29.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.806 0.336 . . . . 0.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.02 -25.9 63.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.223 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -55.99 -68.29 0.22 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.131 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' HG2' ' CE1' ' A' ' 102' ' ' PHE . 3.1 tp10 -75.64 173.45 11.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.02 100.0 4.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.852 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.696 HD11 ' CB ' ' A' ' 100' ' ' ARG . 2.5 tp -77.22 159.0 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.038 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.4 pt -62.95 127.58 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.11 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 m -88.11 106.84 18.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.799 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.08 101.83 11.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -146.09 153.37 40.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.991 -179.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -82.2 157.0 24.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.951 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -111.39 113.85 26.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.925 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.567 ' O ' HG23 ' A' ' 34' ' ' THR . 7.8 t -70.68 84.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -137.31 -74.77 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.955 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.97 -70.08 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -88.39 105.61 17.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.923 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -152.27 -46.63 0.1 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.081 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.507 ' HB3' ' CD1' ' A' ' 71' ' ' LEU . . . -129.96 17.49 5.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.445 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 60.75 79.75 0.24 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -65.54 -29.9 76.25 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.511 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.8 tp -54.64 153.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.822 0.344 . . . . 0.0 111.388 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -78.68 -62.15 1.78 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -106.25 129.12 54.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -103.54 163.34 12.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.911 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -71.48 -115.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.43 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -137.56 63.22 0.57 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.514 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.5 t -156.91 87.42 1.0 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 110.861 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 169.92 -32.5 0.16 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.509 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.67 -93.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.502 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -93.73 89.25 6.11 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.831 0.348 . . . . 0.0 110.923 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.6 mtt -131.42 161.32 32.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.877 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 136.25 -74.21 0.42 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.474 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.4 m -106.65 131.91 53.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.869 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 105.49 134.0 7.78 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.454 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -105.1 -160.67 23.55 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.494 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.597 HG22 ' HD2' ' A' ' 58' ' ' PRO . 0.2 OUTLIER -84.14 141.2 40.02 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.663 0.268 . . . . 0.0 110.897 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HD2' HG22 ' A' ' 57' ' ' THR . 60.8 Cg_endo -72.78 164.51 35.37 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.443 2.095 . . . . 0.0 112.262 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 57.09 28.51 15.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.754 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -96.83 135.03 22.35 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.451 ' HD2' HD12 ' A' ' 60' ' ' ILE . 16.0 Cg_endo -58.55 125.94 19.86 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.431 2.087 . . . . 0.0 111.994 179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 136.14 33.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.174 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -58.24 164.17 2.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.904 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.649 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -89.48 114.63 26.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.37 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 128.05 -68.37 0.54 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.538 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 11.7 p -108.43 141.98 39.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 110.912 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.51 83.91 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.015 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 179.57 126.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.754 ' CD2' HG21 ' A' ' 60' ' ' ILE . 22.8 p80 -63.9 168.2 5.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.909 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.882 HD11 ' NE2' ' A' ' 82' ' ' HIS . 0.2 OUTLIER -106.32 160.13 6.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.097 0.475 . . . . 0.0 110.818 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.507 ' CD1' ' HB3' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -173.21 35.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.292 179.697 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -99.24 -178.61 3.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.847 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -72.76 0.22 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.419 ' O ' HD13 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -83.67 144.14 29.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.419 HD13 ' O ' ' A' ' 74' ' ' PHE . 37.0 mm -145.44 146.91 19.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.993 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.0 mp -108.63 106.81 17.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.412 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -91.05 134.73 34.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -167.6 164.28 14.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.182 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.798 HD12 ' CE2' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 58.88 37.46 24.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.08 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 61.61 28.79 17.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -166.03 176.14 7.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.982 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.882 ' NE2' HD11 ' A' ' 70' ' ' ILE . 21.8 p-80 -94.09 128.8 40.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.9 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.798 ' CE2' HD12 ' A' ' 79' ' ' LEU . 42.2 m95 -119.64 133.2 55.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.725 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 171.72 0.27 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.911 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 t -80.05 -39.76 29.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.3 pttt -90.95 -29.08 17.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.13 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 62.8 m -67.65 -30.76 70.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.953 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.591 HD21 HG21 ' A' ' 28' ' ' ILE . 5.4 tp -68.43 75.8 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.888 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -120.73 136.82 54.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.841 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -58.26 135.3 57.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.941 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 3.4 m -80.1 -0.89 37.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.681 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 6.3 t0 -107.78 -63.02 1.36 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.716 0.293 . . . . 0.0 111.356 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.483 ' SG ' HG23 ' A' ' 95' ' ' VAL . 30.2 p -94.14 -21.09 19.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.456 -179.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 59.11 39.76 22.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.9 0.381 . . . . 0.0 110.853 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.483 HG23 ' SG ' ' A' ' 93' ' ' CYS . 22.0 t -107.84 129.71 23.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.113 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.1 118.89 3.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.568 2.179 . . . . 0.0 112.479 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.677 HD23 ' O ' ' A' ' 100' ' ' ARG . 8.5 mp -85.18 -75.39 0.36 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.75 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . 57.38 31.82 20.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.238 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.453 ' N ' HD11 ' A' ' 28' ' ' ILE . 6.4 mm-40 -156.45 -75.91 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.924 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.696 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -119.4 130.44 55.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.957 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.731 ' HB2' HG23 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -121.95 128.0 51.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.931 -179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.416 ' CE1' ' HG2' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -114.72 155.82 25.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.851 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 38.9 t -133.21 136.19 45.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.987 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 10.5 mmt-85 -153.91 123.95 6.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.72 -60.58 4.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -176.54 -43.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 0.0 110.937 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 12.9 m -73.35 -170.77 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.876 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.0 p -113.03 122.91 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.06 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.414 ' CZ ' ' HB2' ' A' ' 92' ' ' ASP . 2.0 m-85 -119.26 155.79 31.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.845 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 29.0 p -102.39 149.24 24.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.706 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 2.5 mtmp? -54.57 -40.04 68.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.194 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -59.12 -29.53 67.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.923 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -84.12 -29.75 26.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.487 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 14.3 t80 -64.94 -30.22 71.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 111' ' ' LYS . 3.5 m-85 -77.21 -41.22 42.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.4 mtmm -81.35 -28.01 34.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.023 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 38.3 mmt180 -96.04 -55.47 2.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.22 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.451 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 12.4 m-85 -104.08 29.66 5.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.195 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.73 -151.14 5.7 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.278 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.732 HG21 ' SD ' ' A' ' 16' ' ' MET . 1.7 m -103.01 153.49 20.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.8 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -144.85 -164.99 2.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.958 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 32.4 t -116.5 139.05 50.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.958 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -104.96 24.97 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.28 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.434 ' HB2' ' CD1' ' A' ' 143' ' ' TYR . . . -125.13 -53.13 1.63 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.976 179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.21 -16.57 13.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.247 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.8 ' O ' HD12 ' A' ' 127' ' ' LEU . 1.2 tt0 71.14 79.45 0.17 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.831 0.348 . . . . 0.0 111.01 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.8 HD12 ' O ' ' A' ' 126' ' ' GLN . 0.4 OUTLIER -156.72 133.82 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.646 179.775 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -57.34 99.83 0.11 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.726 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.612 HG23 ' HD2' ' A' ' 130' ' ' PRO . 59.0 mt -62.49 141.54 96.62 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 120.548 0.214 . . . . 0.0 110.769 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HD2' HG23 ' A' ' 129' ' ' ILE . 78.6 Cg_exo -42.83 168.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.736 2.291 . . . . 0.0 112.772 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -77.14 -55.64 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.926 2.417 . . . . 0.0 114.737 -178.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.478 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 2.0 m -126.43 21.96 7.13 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -177.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.568 ' HG2' ' CB ' ' A' ' 130' ' ' PRO . 71.2 mm-40 -58.17 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.322 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.799 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -129.13 108.61 17.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.738 0.304 . . . . 0.0 111.112 179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.4 p -143.49 157.68 16.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.74 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.476 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.48 134.96 39.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.064 0.459 . . . . 0.0 111.252 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.0 172.97 6.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.528 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.545 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -146.31 168.97 19.79 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.229 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.683 ' HG3' HD22 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 40.73 -83.82 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.55 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.545 ' N ' ' O ' ' A' ' 138' ' ' ALA . 21.7 t0 -162.09 38.12 0.12 Allowed 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 120.732 0.301 . . . . 0.0 111.19 179.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.404 ' HB2' ' CZ ' ' A' ' 143' ' ' TYR . 0.6 OUTLIER -153.43 157.17 39.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.698 179.717 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.606 HG13 HD12 ' A' ' 129' ' ' ILE . 11.6 p -109.67 153.18 11.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.668 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.655 ' OH ' HD11 ' A' ' 165' ' ' LEU . 14.6 m-85 -143.47 147.54 34.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.023 0.44 . . . . 0.0 111.35 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 77.8 m80 -57.84 143.68 41.52 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.37 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.799 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -65.05 -17.93 64.87 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 176.761 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.3 m170 -82.53 -41.06 20.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.222 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 15.7 p -90.41 -25.79 20.2 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.636 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.542 ' CE1' HD21 ' A' ' 171' ' ' LEU . 2.1 t80 -60.54 91.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.84 0.352 . . . . 0.0 110.657 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.548 ' HB1' ' C ' ' A' ' 155' ' ' ARG . . . -167.78 174.25 7.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 49.5 t -76.23 150.25 37.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.992 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.612 HG11 ' CG ' ' A' ' 170' ' ' ARG . 6.4 m -74.89 -35.56 36.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.345 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.51 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -88.75 -57.55 4.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.412 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.8 m -65.86 -28.09 68.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.157 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt 60.31 38.72 19.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . 0.548 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 22.4 ttm-85 -128.96 145.14 51.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.028 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -78.29 155.94 29.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.028 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -106.46 168.72 8.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.675 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.401 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -146.04 166.94 24.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.315 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 6.5 m -43.37 122.04 2.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.539 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 103.73 -23.94 31.14 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.614 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.536 ' C ' HG23 ' A' ' 9' ' ' VAL . 4.9 t0 -77.29 129.0 35.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.848 0.356 . . . . 0.0 110.88 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 33.3 mt-10 -87.98 121.65 30.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.941 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.651 ' CD2' HD23 ' A' ' 171' ' ' LEU . 17.8 p90 -131.07 179.04 6.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.233 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CZ ' ' HB ' ' A' ' 7' ' ' VAL . 0.7 OUTLIER -132.63 114.91 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.525 179.839 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.683 HD22 ' HG3' ' A' ' 139' ' ' GLN . 7.7 tt -93.73 110.81 22.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.833 0.349 . . . . 0.0 110.51 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 1.1 mmt -72.19 159.95 33.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -51.76 -25.57 7.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.89 27.61 3.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.188 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 5.0 m 55.45 31.19 16.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.024 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.612 ' CG ' HG11 ' A' ' 151' ' ' VAL . 14.9 ttm180 -94.72 102.84 14.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.031 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.651 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.3 OUTLIER -66.97 126.77 30.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.898 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.647 HG23 ' OD2' ' A' ' 176' ' ' ASP . 8.6 p -145.34 140.73 22.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.711 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.9 155.09 23.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.775 0.321 . . . . 0.0 110.963 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.618 ' HE2' HG11 ' A' ' 7' ' ' VAL . 8.7 mtmt -60.51 -30.16 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.769 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -62.35 -59.07 5.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.272 -179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.647 ' OD2' HG23 ' A' ' 172' ' ' VAL . 4.8 p-10 -81.39 -0.18 40.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.404 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.457 ' CZ ' ' HE2' ' A' ' 181' ' ' LYS . 8.7 t80 -61.67 -65.74 0.64 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.939 0.399 . . . . 0.0 110.657 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -57.21 -26.77 61.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.128 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 59.0 m -75.4 -22.84 57.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.339 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . 0.529 ' HB3' ' HZ3' ' A' ' 181' ' ' LYS . . . -97.01 -32.19 12.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.798 0.332 . . . . 0.0 111.31 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . 0.529 ' HZ3' ' HB3' ' A' ' 180' ' ' ALA . 0.0 OUTLIER -171.93 -177.27 1.89 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.879 -179.813 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.866 179.892 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.4 p . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.842 0.354 . . . . 0.0 111.199 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 t -100.48 -46.96 5.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.927 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.4 tm0? 62.37 149.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.5 m -118.4 82.64 19.34 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.088 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.33 166.11 29.39 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.625 2.217 . . . . 0.0 112.298 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 60.25 81.01 0.19 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.922 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 8' ' ' MET . 12.9 p -125.96 158.63 35.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.131 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.595 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -129.42 -175.04 3.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.723 179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.519 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.6 p -154.98 134.48 3.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.16 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.443 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.0 t -58.15 146.12 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -128.46 -169.35 12.6 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.482 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -60.35 146.19 84.78 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.565 0.221 . . . . 0.0 110.687 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.876 ' HB2' HG12 ' A' ' 134' ' ' VAL . 3.4 Cg_exo -77.89 129.96 10.18 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.57 2.18 . . . . 0.0 112.238 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.75 154.61 35.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.441 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.654 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -138.73 173.72 11.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.143 0.497 . . . . 0.0 111.555 -179.631 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.444 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -48.69 -50.57 32.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.979 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.649 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 59.46 96.1 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.525 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.76 -66.15 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.562 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 60.79 95.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.503 ' CE2' ' CE1' ' A' ' 115' ' ' PHE . 11.0 p90 -58.71 -32.6 69.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 86.67 129.88 2.71 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.491 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.601 ' O ' HD13 ' A' ' 27' ' ' LEU . 3.0 p30 -58.01 -28.38 64.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.737 0.304 . . . . 0.0 111.124 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -64.48 -51.13 64.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.114 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.43 -36.44 71.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.076 -179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.415 ' HG3' ' CE2' ' A' ' 102' ' ' PHE . 31.3 mm-40 -72.74 176.03 5.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -75.83 100.0 4.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.808 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -101.4 144.03 30.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.95 -179.875 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.695 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.8 pt -63.01 148.15 11.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.123 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.8 m -118.02 106.88 13.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.794 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -77.23 101.86 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.642 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -138.49 160.22 40.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.018 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -74.3 119.63 18.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -59.45 -28.41 66.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.011 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m 63.48 34.14 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.935 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -130.53 76.84 1.75 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -98.66 31.41 2.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.924 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -152.15 78.53 1.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -156.42 -45.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.095 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB3' HD22 ' A' ' 71' ' ' LEU . . . -150.79 169.89 20.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.104 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -60.31 90.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.929 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.21 -154.1 25.77 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.509 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.502 HG23 ' N ' ' A' ' 43' ' ' ASP . 4.8 tp -52.25 -44.97 43.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.863 0.363 . . . . 0.0 111.519 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.502 ' N ' HG23 ' A' ' 42' ' ' ILE . 2.8 m-20 -60.78 149.88 34.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.934 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -133.05 129.94 38.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.855 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -79.98 -34.36 38.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.48 -46.53 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.503 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -153.24 140.16 7.4 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.487 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 95.9 p -176.25 -41.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.839 0.352 . . . . 0.0 110.864 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.23 -170.74 33.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.507 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.48 50.22 1.28 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.53 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -152.73 -178.47 6.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.31 . . . . 0.0 110.934 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.5 tpt -84.69 149.44 25.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.94 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 160.06 -31.43 0.4 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.52 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.9 m -107.18 -31.23 8.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.883 0.373 . . . . 0.0 110.951 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -64.11 -133.2 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.501 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.0 75.01 1.28 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.514 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.98 87.53 51.42 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.757 0.313 . . . . 0.0 110.929 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_exo -51.58 164.68 0.85 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.524 2.149 . . . . 0.0 112.334 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 59.24 31.36 21.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.573 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -109.97 134.91 20.55 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.046 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.448 ' HD2' HD12 ' A' ' 60' ' ' ILE . 17.9 Cg_endo -60.94 125.91 18.29 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.422 2.081 . . . . 0.0 112.122 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.59 140.6 29.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.074 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.8 164.29 2.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.443 ' CB ' ' CD2' ' A' ' 83' ' ' TRP . . . -85.83 114.63 22.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.33 -73.03 0.38 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.613 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 14.2 p -100.26 153.63 19.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.822 0.344 . . . . 0.0 111.004 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -75.08 86.51 2.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -179.03 133.6 0.12 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.953 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.573 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.4 p80 -70.55 161.0 31.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.59 ' C ' HD23 ' A' ' 71' ' ' LEU . 9.6 mm -94.5 153.67 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.982 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.59 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.99 0.14 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.925 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.12 170.27 7.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.926 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.88 -74.18 0.33 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.673 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -67.94 91.7 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.661 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.603 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.4 OUTLIER -104.95 140.79 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.997 -179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.603 ' H ' HD13 ' A' ' 75' ' ' ILE . 7.6 mp -89.87 106.9 18.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.584 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -90.77 115.02 27.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.564 ' HB2' HG22 ' A' ' 28' ' ' ILE . . . -156.5 156.78 34.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.275 -179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.817 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 61.69 36.34 16.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.056 180.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 62.18 29.9 17.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.063 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -168.21 -178.45 3.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.413 ' HB2' HD12 ' A' ' 75' ' ' ILE . 26.2 p-80 -100.11 125.29 46.2 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.946 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.817 ' NE1' HD12 ' A' ' 79' ' ' LEU . 37.0 m95 -114.34 132.82 56.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.826 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.454 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.64 172.2 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.873 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.12 -40.12 28.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.98 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -91.0 -29.78 17.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.22 -30.92 70.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.763 HD23 ' O ' ' A' ' 97' ' ' LEU . 9.7 tp -72.29 77.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.874 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -135.6 165.72 24.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.873 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.78 138.44 41.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.84 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -29.58 68.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.914 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -105.08 -59.79 1.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 16.3 m -61.43 -39.9 92.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.7 t-160 58.48 22.29 9.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.02 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 6.6 m -85.78 156.25 58.46 Favored Pre-proline 0 N--CA 1.452 -0.362 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.219 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -59.66 118.9 5.84 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.607 2.205 . . . . 0.0 112.159 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.763 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.8 mp -112.96 54.89 0.71 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.712 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.429 ' C ' HD11 ' A' ' 28' ' ' ILE . . . -97.76 30.21 3.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.138 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.448 ' N ' HD11 ' A' ' 28' ' ' ILE . 22.2 mt-10 -141.48 -47.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.814 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.85 135.7 38.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.695 ' HB2' HG23 ' A' ' 28' ' ' ILE . 1.5 t -121.44 170.94 9.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.014 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.502 ' CZ ' ' CD2' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -176.97 120.0 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.609 -179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 t -131.72 157.72 43.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.876 0.37 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -170.22 124.0 0.72 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.887 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 90.12 -94.27 1.96 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.497 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -147.87 36.01 0.85 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.801 0.334 . . . . 0.0 110.896 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 66.6 m -159.42 -176.88 6.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.839 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.535 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.6 p -136.3 116.19 16.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.129 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -110.47 166.87 10.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 22.6 p -90.83 168.07 11.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.685 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HD2' ' CZ ' ' A' ' 115' ' ' PHE . 0.1 OUTLIER -56.35 -44.92 80.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.962 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 12.2 t70 -66.66 -24.22 66.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.056 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -77.82 -21.0 52.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.35 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.502 ' CD2' ' CZ ' ' A' ' 102' ' ' PHE . 11.6 t80 -67.99 -44.08 77.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.874 0.368 . . . . 0.0 110.891 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.503 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 18.1 m-85 -60.67 -41.4 95.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -81.27 -30.43 34.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.351 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -80.96 -54.05 5.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.288 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -105.58 -43.09 5.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.104 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -59.53 164.71 11.28 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.487 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.404 ' HB ' ' HE1' ' A' ' 16' ' ' MET . 85.8 m -60.72 155.08 19.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.774 0.321 . . . . 0.0 110.719 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -140.28 172.51 12.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.07 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.492 ' N ' HD11 ' A' ' 129' ' ' ILE . 42.6 t -85.34 130.57 34.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.679 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.17 28.42 3.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.144 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.739 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.16 -53.76 1.61 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.96 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.78 -16.09 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.234 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 65.8 71.74 0.42 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.898 0.38 . . . . 0.0 110.81 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.437 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.8 OUTLIER -128.09 -164.57 1.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.815 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -104.72 107.03 2.82 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.721 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.654 ' CG2' HD11 ' A' ' 15' ' ' LEU . 8.5 mt -87.89 127.35 58.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.4 0.143 . . . . 0.0 110.622 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 52.1 Cg_exo -53.14 177.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.241 1.96 . . . . 0.0 112.316 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -77.23 -49.16 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 123.082 2.522 . . . . 0.0 113.554 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.649 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.6 m -126.07 21.9 7.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.612 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -53.35 -175.49 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.328 . . . . 0.0 110.692 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.928 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -125.48 109.69 22.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 111.069 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.653 HG21 ' O ' ' A' ' 143' ' ' TYR . 14.5 p -156.95 160.34 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.133 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.504 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.87 138.13 34.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.652 179.896 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.412 ' CG ' HG23 ' A' ' 142' ' ' VAL . 0.3 OUTLIER -104.91 136.01 45.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.979 -179.833 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.6 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -74.83 96.65 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.556 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 54.38 -87.16 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.087 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -96.88 -48.17 5.55 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.823 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.679 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.3 m-85 -84.4 163.01 19.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.644 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.43 HG11 ' CD1' ' A' ' 129' ' ' ILE . 9.9 p -108.62 151.31 10.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.708 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.739 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 13.7 m-85 -129.01 170.21 13.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.945 0.403 . . . . 0.0 111.299 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 37.7 m80 -97.56 140.19 32.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.955 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.928 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.07 -21.26 44.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -91.13 -38.66 12.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.306 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -98.73 12.45 35.48 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.226 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.864 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 53.5 t80 -101.56 101.63 12.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.759 0.314 . . . . 0.0 110.714 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -158.94 177.76 10.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 45.2 t -86.48 150.18 24.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.939 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.605 HG11 ' HG2' ' A' ' 170' ' ' ARG . 27.6 m -72.17 -36.69 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.317 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.597 HG21 ' HB2' ' A' ' 176' ' ' ASP . 21.3 t -88.4 -56.94 4.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.498 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.6 m -65.87 -28.09 68.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.159 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? 59.66 32.84 21.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.943 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -128.97 153.01 47.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.03 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.594 ' C ' HD22 ' A' ' 157' ' ' LEU . 12.8 mt-30 -72.16 174.54 7.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.884 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.714 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -128.12 173.31 10.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.847 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 163.51 35.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.963 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 11.2 t -46.8 129.36 11.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.245 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 101.85 -25.31 28.38 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.464 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.519 ' C ' HG23 ' A' ' 9' ' ' VAL . 1.6 t70 -70.45 129.18 38.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.821 0.343 . . . . 0.0 110.779 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -87.95 122.0 31.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.04 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.595 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 5.4 p90 -139.25 155.45 47.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.955 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.451 ' CD2' ' CD1' ' A' ' 177' ' ' TYR . 34.4 m-85 -103.02 171.08 7.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.612 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.6 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -130.3 114.46 15.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.893 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 3.4 mmt -70.73 -178.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.895 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -75.11 -28.71 60.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.994 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -97.58 28.96 3.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.057 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.07 43.63 24.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.021 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.605 ' HG2' HG11 ' A' ' 151' ' ' VAL . 0.1 OUTLIER -100.72 124.09 45.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.864 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -74.66 120.83 20.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.805 -179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.726 HG23 ' OD2' ' A' ' 176' ' ' ASP . 12.5 p -145.3 127.39 9.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.109 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.1 m -72.34 -173.19 1.05 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.889 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.435 ' CE ' HG21 ' A' ' 7' ' ' VAL . 12.7 mttt -85.94 -32.24 21.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.84 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.42 -52.33 54.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.15 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.726 ' OD2' HG23 ' A' ' 172' ' ' VAL . 7.2 p-10 -85.21 3.98 36.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.429 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.451 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 10.6 t80 -59.17 -66.05 0.57 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.964 0.411 . . . . 0.0 110.763 179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.32 -27.89 57.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.867 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 85.9 m -77.83 -35.43 51.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . 0.499 ' HB2' ' CG2' ' A' ' 152' ' ' VAL . . . -97.11 4.04 51.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.579 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.3 -177.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 110.862 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.914 179.977 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.2 t . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.828 0.347 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m 60.4 31.5 20.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 60.75 111.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.951 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 4' ' ' VAL . 10.9 m -126.69 82.79 66.48 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.085 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.33 -42.69 2.63 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.535 2.157 . . . . 0.0 112.31 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -141.76 87.8 2.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.912 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.488 HG22 ' N ' ' A' ' 8' ' ' MET . 12.0 p -121.77 158.6 25.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.488 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.07 -177.12 5.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.69 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.557 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.4 p -154.97 135.09 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.141 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.447 HG22 ' CE1' ' A' ' 163' ' ' PHE . 47.9 t -59.27 146.17 9.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.63 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -133.88 -169.11 11.98 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.482 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.4 mm-40 -56.3 135.5 75.68 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.549 0.214 . . . . 0.0 110.744 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.636 ' HB2' HG12 ' A' ' 134' ' ' VAL . 17.2 Cg_exo -64.54 135.62 46.54 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.382 2.054 . . . . 0.0 112.385 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.6 t -162.94 147.69 11.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.544 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.757 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -117.77 173.35 6.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.109 0.48 . . . . 0.0 111.285 -179.658 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.62 ' SD ' HG21 ' A' ' 120' ' ' THR . 0.0 OUTLIER -60.58 -36.24 78.05 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.721 179.748 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.916 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 57.66 74.88 0.29 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.09 -60.96 0.48 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.478 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 62.61 97.68 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.825 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.494 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.2 OUTLIER -59.22 -166.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.899 179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -137.43 147.44 19.23 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.538 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -84.03 -35.74 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.98 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -89.5 7.12 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.366 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.18 -31.22 34.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 33.4 tp10 -109.66 164.25 12.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.875 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -75.97 99.96 4.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.951 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 101' ' ' CYS . 2.0 tp -79.72 165.07 23.2 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.904 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.813 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.6 pt -62.89 164.16 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.464 HG22 ' HG ' ' A' ' 31' ' ' LEU . 59.5 m -126.82 107.07 9.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.774 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.99 101.78 6.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.547 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.09 151.26 36.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.952 -179.803 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -82.04 156.97 24.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -115.7 144.44 43.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 p -96.85 40.02 1.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.414 ' CG ' ' HB2' ' A' ' 38' ' ' ALA . 0.2 OUTLIER -87.53 -70.29 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.84 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 63.7 -79.47 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.007 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -69.82 -75.12 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.919 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.414 ' HB2' ' CG ' ' A' ' 35' ' ' GLN . . . 64.68 -78.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.132 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.721 ' HB2' HG21 ' A' ' 57' ' ' THR . . . -165.62 108.63 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.092 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 60.71 32.5 20.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.947 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.74 -29.84 68.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.484 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.7 mm -82.3 104.06 10.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.855 0.36 . . . . 0.0 110.943 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.34 87.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -132.22 -46.69 0.92 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -65.03 118.3 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.89 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -136.69 122.66 2.66 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 71.73 113.4 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.489 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 t -133.46 177.89 7.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.867 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.88 46.3 3.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.487 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.45 28.45 2.88 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.514 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -165.39 -49.56 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.822 0.344 . . . . 0.0 110.936 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -176.4 -44.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.972 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 136.19 143.89 4.76 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.483 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.5 p -87.55 -74.65 0.44 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.757 0.313 . . . . 0.0 110.844 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 133.52 132.6 3.27 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.501 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -103.04 -163.02 25.72 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.462 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.721 HG21 ' HB2' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -107.03 82.97 1.21 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.0 110.965 179.998 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.45 169.0 18.09 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.534 2.156 . . . . 0.0 112.207 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 58.41 29.09 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.834 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.581 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.2 tp -99.49 135.5 20.62 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.033 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.447 ' HD2' HD12 ' A' ' 60' ' ' ILE . 11.8 Cg_endo -56.39 125.93 20.65 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.407 2.071 . . . . 0.0 112.047 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.12 137.94 31.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.3 p -58.37 164.22 2.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.881 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -87.25 114.63 24.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.533 179.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 124.27 -71.48 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.66 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 12.5 p -103.48 155.68 18.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.945 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.37 88.3 3.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.112 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -178.44 136.62 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.945 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.581 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.8 p80 -73.67 157.13 37.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.009 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.528 HD11 ' CD2' ' A' ' 84' ' ' HIS . 3.9 mm -88.77 151.55 3.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.85 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.92 37.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.019 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -103.36 179.91 4.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.12 -39.8 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.713 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -109.21 110.22 21.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.446 HG22 ' N ' ' A' ' 76' ' ' LEU . 40.9 mm -120.0 154.79 22.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.389 -179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.446 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.53 107.06 15.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.093 179.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.7 119.0 30.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.043 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -153.01 162.71 41.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.148 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.733 HD12 ' NE1' ' A' ' 83' ' ' TRP . 1.0 OUTLIER 57.01 36.32 27.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 62.54 30.38 17.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.009 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 21.0 mtt180 -164.2 -178.99 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.015 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.405 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 32.9 p-80 -98.8 121.24 40.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.022 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.733 ' NE1' HD12 ' A' ' 79' ' ' LEU . 46.1 m95 -112.48 130.46 55.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.817 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.528 ' CD2' HD11 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -56.39 171.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.881 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.6 t -79.93 -41.08 26.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.991 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -89.77 -28.61 19.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.016 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 96.8 m -69.83 -30.78 68.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.945 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.669 HD23 ' O ' ' A' ' 97' ' ' LEU . 8.1 tp -72.14 80.39 0.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.057 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 14.4 mmtt -144.63 141.12 29.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.914 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 11.6 t -59.8 132.45 54.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.817 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.1 m -77.85 -4.3 45.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.504 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -111.31 -31.8 6.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.802 0.334 . . . . 0.0 111.065 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 95' ' ' VAL . 14.1 m -111.87 -30.48 7.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.149 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 9.9 t-160 60.77 25.26 15.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.944 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 93' ' ' CYS . 3.5 m -85.27 159.84 55.61 Favored Pre-proline 0 N--CA 1.453 -0.299 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.213 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.494 ' O ' HD12 ' A' ' 97' ' ' LEU . 35.7 Cg_exo -59.9 121.2 9.45 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.685 2.257 . . . . 0.0 112.312 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.669 ' O ' HD23 ' A' ' 88' ' ' LEU . 5.6 mp -124.55 30.48 5.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.698 179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.49 61.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.555 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.813 ' C ' HD11 ' A' ' 28' ' ' ILE . 5.4 mt-10 -92.04 -39.9 11.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 110.994 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.465 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -140.17 170.74 15.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.893 179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.742 ' HB2' HG23 ' A' ' 28' ' ' ILE . 53.3 t -150.89 156.16 40.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.826 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.437 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.8 t80 -157.94 119.91 3.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.79 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.466 ' HB3' HD22 ' A' ' 79' ' ' LEU . 10.8 t -130.83 162.27 29.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 4.2 mmm-85 -153.63 124.04 7.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.881 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 72.77 -78.54 0.74 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.473 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -133.91 -74.29 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.778 0.323 . . . . 0.0 110.861 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.1 m -59.8 164.66 3.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.537 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.3 p -107.3 115.93 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -117.65 120.89 39.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.799 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 27.3 p -60.09 170.51 1.22 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.2 OUTLIER -78.11 -31.88 50.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.196 -179.739 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -50.82 -58.01 7.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.438 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -75.53 -20.97 58.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.494 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 9.5 t80 -60.14 -26.97 66.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.906 0.384 . . . . 0.0 110.675 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -79.28 -44.3 21.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.956 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -85.29 -62.0 1.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.721 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.05 -50.77 72.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.78 -179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 6.0 m-85 -88.29 -43.03 11.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.684 0.278 . . . . 0.0 111.362 -179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.76 -168.36 36.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.432 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.62 HG21 ' SD ' ' A' ' 16' ' ' MET . 24.3 m -58.95 148.69 29.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -151.38 162.22 41.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.803 ' HB2' HD11 ' A' ' 129' ' ' ILE . 42.5 t -79.83 127.6 32.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.943 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -98.55 30.67 3.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.998 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.835 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -124.99 -56.39 1.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.058 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 22.7 p -110.74 -22.43 11.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.11 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 71.47 73.22 0.18 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.957 0.408 . . . . 0.0 110.912 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.443 ' HB3' ' CE1' ' A' ' 144' ' ' HIS . 0.5 OUTLIER -128.53 -164.54 1.39 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.807 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -109.38 106.11 2.16 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.616 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.803 HD11 ' HB2' ' A' ' 122' ' ' CYS . 2.4 mt -94.97 128.02 40.75 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.448 0.166 . . . . 0.0 110.657 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.619 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.7 Cg_exo -52.25 175.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.196 1.931 . . . . 0.0 112.197 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.37 -47.3 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.646 2.23 . . . . 0.0 113.871 -179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.916 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.53 21.91 7.73 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -178.177 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.654 HE21 HG23 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -56.73 -170.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.594 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.636 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.15 108.66 23.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.751 0.31 . . . . 0.0 110.544 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.757 HG12 ' HG ' ' A' ' 15' ' ' LEU . 10.2 p -157.19 161.72 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.167 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.543 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 135.06 39.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.246 179.503 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.722 ' HB3' HG23 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -115.65 144.43 43.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.088 -179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.815 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -84.45 96.67 9.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.44 -89.26 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.529 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 138' ' ' ALA . 2.1 m-20 -84.61 -44.5 13.43 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.749 -177.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.437 ' CE1' ' HB3' ' A' ' 169' ' ' SER . 7.2 m-85 -91.64 167.21 12.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.473 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.722 HG23 ' HB3' ' A' ' 137' ' ' ARG . 9.3 p -124.61 119.78 57.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.901 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.835 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 6.0 m-85 -102.98 138.7 39.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.443 ' CE1' ' HB3' ' A' ' 127' ' ' LEU . 64.4 m80 -60.82 141.27 57.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.677 HD23 ' HB ' ' A' ' 135' ' ' VAL . 0.4 OUTLIER -61.29 -18.79 60.23 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.433 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -88.24 -36.7 16.6 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.912 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 0.9 OUTLIER -100.89 21.27 13.94 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.447 -179.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.702 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 5.6 t80 -89.8 109.75 20.73 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.841 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.08 157.71 4.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.959 0.409 . . . . 0.0 111.259 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.16 150.43 21.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 171' ' ' LEU . 10.8 m -91.09 22.47 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.508 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 39.2 t -136.74 -62.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.813 0.339 . . . . 0.0 110.618 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 23.9 p -85.02 -20.83 29.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.653 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 3.4 mtpm? 65.01 61.75 0.75 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.193 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -129.13 137.58 51.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.071 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 157' ' ' LEU . 13.5 mt-30 -68.17 154.06 42.46 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.725 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.4 OUTLIER -122.68 147.1 46.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.64 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -127.54 165.89 19.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.0 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -46.05 128.2 9.09 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.206 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 104.17 -26.67 22.24 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.557 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.5 m-20 -70.82 128.96 37.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.788 0.328 . . . . 0.0 110.813 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -87.99 118.84 27.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.035 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.686 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.2 p90 -135.63 151.28 50.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.44 ' CE2' ' HG3' ' A' ' 174' ' ' LYS . 26.0 m-85 -97.06 171.01 8.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.795 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.815 HD11 ' HB1' ' A' ' 138' ' ' ALA . 2.8 tp -132.22 118.39 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.782 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 4.7 mmt -56.38 164.26 1.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.014 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -58.2 -30.46 66.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.159 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.92 -79.04 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.994 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . 0.437 ' HB3' ' CE1' ' A' ' 141' ' ' PHE . 36.5 p 178.99 77.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.804 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.582 ' CG ' HG11 ' A' ' 151' ' ' VAL . 7.6 mtt180 -144.5 119.38 9.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.702 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.4 OUTLIER -66.92 121.43 15.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.841 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . . . . . . . . . 8.5 p -139.09 140.76 37.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.001 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.1 p -92.31 160.99 14.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' A' ' 164' ' ' TYR . 9.4 mttp -58.12 -46.84 84.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.136 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.35 -27.15 62.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.308 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -104.07 -6.87 20.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.452 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.447 ' CE2' ' CB ' ' A' ' 182' ' ' GLN . 8.3 t80 -56.2 -66.04 0.5 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.843 0.354 . . . . 0.0 110.986 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -63.6 -31.37 72.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.928 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.03 -31.5 67.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.873 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -78.29 -52.02 9.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.137 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.13 -67.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.947 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . 0.447 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.922 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.85 0.357 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -134.65 88.82 2.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -131.87 36.79 3.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.2 m -138.56 149.84 64.0 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.161 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.09 -168.03 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.92 103.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.487 HG22 ' N ' ' A' ' 8' ' ' MET . 14.2 p -123.96 158.87 29.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.189 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.597 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -140.95 179.18 6.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.716 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.523 HG23 ' C ' ' A' ' 161' ' ' ASP . 7.3 p -155.11 133.81 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.124 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG23 ' CD1' ' A' ' 163' ' ' PHE . 48.1 t -54.8 146.31 4.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.662 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.488 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -143.23 -140.76 3.73 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.702 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 24.3 mt-10 -72.96 117.04 56.47 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.527 0.204 . . . . 0.0 110.865 -179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.92 ' HB2' HG12 ' A' ' 134' ' ' VAL . 16.3 Cg_exo -65.03 137.51 52.87 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.388 2.059 . . . . 0.0 112.115 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -163.05 153.96 16.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.787 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.814 ' HG ' HG12 ' A' ' 135' ' ' VAL . 1.0 OUTLIER -124.86 173.47 8.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.109 0.481 . . . . 0.0 111.22 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.408 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -66.09 -28.42 68.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.692 179.588 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.926 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.35 61.05 7.82 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.527 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -77.65 -67.13 1.68 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.545 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 65.92 67.72 0.47 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.946 0.403 . . . . 0.0 110.739 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -75.29 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.016 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.03 153.8 30.59 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.461 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.06 -34.19 24.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -62.05 -31.17 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -68.16 0.32 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.432 ' HB3' ' CD1' ' A' ' 102' ' ' PHE . 67.5 mm-40 -65.1 175.99 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.943 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 119.05 19.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.44 HD11 ' CB ' ' A' ' 100' ' ' ARG . 1.7 tp -103.68 165.05 11.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.914 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.853 HG23 ' HB2' ' A' ' 101' ' ' CYS . 7.9 pt -62.88 146.89 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.168 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 34.6 m -113.62 106.86 15.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HD2' HD11 ' A' ' 76' ' ' LEU . 1.3 tpp180 -77.61 101.83 6.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.59 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.05 166.06 26.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.961 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -82.43 157.03 23.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.887 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.1 -29.1 9.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.885 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.71 36.84 13.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.915 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -133.83 77.45 1.71 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 73' ' ' ARG . 47.1 m-85 -80.62 -74.46 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.911 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.87 86.43 4.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.2 -68.57 0.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.061 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.15 17.45 2.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.447 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -168.98 -47.8 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.845 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 81.7 -143.81 23.71 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.55 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.6 mp -84.24 -70.93 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.802 0.334 . . . . 0.0 110.876 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.28 128.62 37.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -103.14 174.7 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.957 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -68.65 -59.18 3.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.62 179.65 26.84 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.546 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.84 -152.84 17.41 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.458 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -147.93 -178.87 6.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.876 0.369 . . . . 0.0 110.929 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 155.87 -73.11 0.24 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.468 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 141.05 -30.73 2.23 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.463 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 -143.54 -178.37 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.785 0.326 . . . . 0.0 110.888 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -138.33 141.17 39.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.92 84.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.49 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.3 p -168.39 33.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.881 0.372 . . . . 0.0 110.89 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.8 168.34 11.51 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.469 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 148.55 -160.69 28.45 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.547 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -115.61 83.01 10.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 120.655 0.264 . . . . 0.0 110.835 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.95 165.86 1.09 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.522 2.148 . . . . 0.0 112.173 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 58.3 30.56 19.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.833 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.496 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.0 tp -107.45 135.22 19.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.991 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.429 ' HD2' HD12 ' A' ' 60' ' ' ILE . 21.9 Cg_endo -62.27 125.9 17.37 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.359 2.04 . . . . 0.0 112.021 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.79 150.69 22.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.033 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.7 t -58.52 140.51 53.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.711 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.478 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -62.1 114.85 3.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.71 28.77 45.62 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.513 -0.851 . . . . 0.0 111.98 -179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.65 -178.9 5.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.876 0.369 . . . . 0.0 110.849 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.6 -28.35 10.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.52 -167.58 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.496 ' CD2' HG21 ' A' ' 60' ' ' ILE . 6.2 p80 -107.54 171.76 7.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.971 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.513 ' C ' HD23 ' A' ' 71' ' ' LEU . 10.4 mm -91.57 153.48 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.059 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.513 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -161.13 29.84 0.14 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.826 179.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.586 ' HB2' HD11 ' A' ' 75' ' ' ILE . 11.1 m-20 -100.36 -178.9 3.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.926 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 36' ' ' PHE . 15.2 tpt180 -86.88 -70.11 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.986 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.596 ' C ' HD12 ' A' ' 75' ' ' ILE . 0.6 OUTLIER -81.35 105.66 12.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.111 179.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.596 HD12 ' C ' ' A' ' 74' ' ' PHE . 1.3 mp -113.12 153.8 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.825 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.543 HD11 ' HD2' ' A' ' 30' ' ' ARG . 8.6 mp -104.79 111.95 24.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.797 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 32.1 tttt -90.95 139.03 31.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.982 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -176.7 150.59 0.84 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.119 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.75 HD21 ' SG ' ' A' ' 101' ' ' CYS . 0.3 OUTLIER 58.64 37.26 25.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.152 179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 62.09 30.35 17.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.111 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.1 ptp180 -166.33 167.97 15.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.895 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 35.3 p-80 -92.45 117.96 30.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.646 ' CB ' HD13 ' A' ' 88' ' ' LEU . 69.3 m95 -105.73 125.13 50.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.67 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.08 175.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.955 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.3 t -77.29 -42.08 38.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.898 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.1 ttpm? -91.14 -34.09 15.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 30.6 m -67.48 -28.2 67.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.983 -179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.646 HD13 ' CB ' ' A' ' 83' ' ' TRP . 48.7 tp -72.8 89.18 1.35 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.908 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 50.3 mttt -152.93 155.94 37.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -59.9 146.97 40.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 4.4 m -73.1 -30.98 64.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 -60.51 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.96 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.414 ' HB2' HG22 ' A' ' 95' ' ' VAL . 35.2 m -59.73 -34.25 72.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 57.77 22.25 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.097 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.442 HG23 HD11 ' A' ' 97' ' ' LEU . 4.2 m -85.18 156.33 60.13 Favored Pre-proline 0 N--CA 1.453 -0.284 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.071 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.38 118.97 6.0 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.471 2.114 . . . . 0.0 112.253 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.568 ' O ' HD23 ' A' ' 88' ' ' LEU . 11.2 mp -111.43 60.8 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.85 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.68 36.08 1.57 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.081 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -153.42 -46.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.881 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.44 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -128.4 138.57 52.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.919 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.853 ' HB2' HG23 ' A' ' 28' ' ' ILE . 49.4 t -131.06 156.97 44.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 104' ' ' ARG . 13.5 t80 -169.08 119.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.74 ' HB2' HD22 ' A' ' 79' ' ' LEU . 10.7 t -97.27 153.18 18.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.44 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -176.71 124.04 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.871 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 76.89 41.07 24.07 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 59.52 31.4 20.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.857 0.361 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.6 m -161.62 165.79 27.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.858 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.543 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.7 p -85.47 115.99 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.058 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -125.63 120.93 32.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.935 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.1 p -69.9 163.61 25.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.712 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.426 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -78.14 -24.96 47.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.353 -179.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.436 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -55.56 -58.16 8.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 111.284 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 42.5 p30 -73.32 -20.75 60.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.254 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.444 ' CD1' ' HB2' ' A' ' 118' ' ' PHE . 32.9 t80 -61.98 -29.13 70.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 6.7 m-85 -72.88 -44.79 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 16.0 mtmt -79.89 -31.85 40.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.055 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -57.84 2.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.062 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.444 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 23.8 m-85 -99.04 31.13 3.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.973 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -153.14 169.06 32.02 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.404 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 86.2 m -59.78 153.56 20.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.765 0.317 . . . . 0.0 110.807 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -154.9 170.66 21.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.03 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 18.8 t -81.22 137.96 35.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.803 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.82 14.03 16.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.51 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.09 -41.54 2.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.937 0.399 . . . . 0.0 111.064 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 3.8 m -105.9 -20.58 13.39 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.095 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 7.4 mp0 64.31 29.27 13.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.947 0.403 . . . . 0.0 110.746 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.6 tp -99.58 150.02 22.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.812 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.93 96.59 0.6 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.652 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.458 ' CG2' ' HD2' ' A' ' 130' ' ' PRO . 5.2 mt -59.86 140.32 90.02 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 120.478 0.18 . . . . 0.0 110.678 179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.645 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 72.6 Cg_exo -48.24 175.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.301 2.001 . . . . 0.0 112.11 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.443 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.5 Cg_endo -77.38 -55.05 0.05 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.365 2.043 . . . . 0.0 113.948 -179.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.926 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.3 OUTLIER -122.36 21.72 10.23 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.645 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.9 OUTLIER -60.07 139.07 57.71 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.649 179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.92 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.4 t -74.89 108.71 6.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.009 0.433 . . . . 0.0 110.826 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.814 HG12 ' HG ' ' A' ' 15' ' ' LEU . 14.0 p -151.78 161.07 3.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.12 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.495 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.81 141.86 29.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.859 0.361 . . . . 0.0 110.591 179.858 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.56 ' HG2' HG22 ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.87 130.03 53.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.975 -179.768 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.695 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -82.56 96.67 8.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.739 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.628 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 55.86 -86.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.451 0.644 . . . . 0.0 111.855 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -100.23 -48.41 4.62 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.043 -0.98 . . . . 0.0 111.954 -177.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -91.34 174.67 7.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.759 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.56 HG22 ' HG2' ' A' ' 137' ' ' ARG . 32.5 t -121.43 150.23 24.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.703 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.695 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 2.6 m-85 -131.34 138.99 49.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.423 ' HB2' ' SG ' ' A' ' 147' ' ' CYS . 70.1 m80 -55.12 144.93 22.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.846 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.5 OUTLIER -64.3 -17.85 64.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.225 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -88.93 -38.34 14.58 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.078 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 1.8 p -95.48 25.21 4.6 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.531 -179.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.832 ' CE1' HD11 ' A' ' 171' ' ' LEU . 0.9 OUTLIER -104.36 112.24 25.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.8 0.333 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.442 ' HB1' ' C ' ' A' ' 154' ' ' LYS . . . -172.03 160.59 5.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.123 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 19.3 t -59.7 150.04 28.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.898 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 152' ' ' VAL . 6.5 m -67.31 -27.31 38.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.343 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.669 HG23 HG23 ' A' ' 151' ' ' VAL . 20.1 t -108.54 -55.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.36 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 40.3 m -66.04 -28.0 68.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.078 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.442 ' C ' ' HB1' ' A' ' 149' ' ' ALA . 9.8 mmtt 55.21 36.78 27.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.997 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -109.8 137.79 47.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.434 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.2 mt-30 -64.02 154.42 34.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.0 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.696 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.4 mm? -113.79 163.85 14.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.703 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.06 170.92 15.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.146 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.488 HG23 ' HA2' ' A' ' 11' ' ' GLY . 4.4 m -44.69 123.03 3.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.501 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 98.92 -24.36 32.56 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.679 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.523 ' C ' HG23 ' A' ' 9' ' ' VAL . 5.0 t0 -67.07 128.98 38.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.879 0.371 . . . . 0.0 110.744 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.482 ' HA ' HG23 ' A' ' 9' ' ' VAL . 5.1 mt-10 -87.87 128.95 35.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.142 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.597 ' CE2' ' HE1' ' A' ' 8' ' ' MET . 12.5 p90 -143.43 141.11 30.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.899 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.601 ' HB2' HG13 ' A' ' 172' ' ' VAL . 14.8 m-85 -97.96 171.07 8.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.796 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.628 HD22 ' OE1' ' A' ' 139' ' ' GLN . 1.5 tp -131.73 110.99 11.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.792 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 5.7 mmt -60.98 172.32 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.917 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -66.11 -30.22 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -98.21 29.18 3.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.44 84.05 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.974 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.434 ' CG ' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -149.49 129.54 13.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.914 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.832 HD11 ' CE1' ' A' ' 148' ' ' PHE . 0.5 OUTLIER -73.74 126.11 29.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.601 HG13 ' HB2' ' A' ' 164' ' ' TYR . 11.3 p -145.06 135.75 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.021 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 29.6 p -80.29 167.23 20.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.875 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -57.54 -49.64 75.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.066 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.41 -26.6 63.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -94.98 -15.45 23.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.261 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.495 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 7.7 t80 -55.58 -66.04 0.49 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.053 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.2 -29.5 70.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 4.3 m -72.81 -33.3 66.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.029 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.6 -30.88 15.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.201 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.4 mmmm 61.44 175.77 0.11 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.956 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.4 p . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t 60.6 158.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.863 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -102.34 -55.1 2.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.91 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.9 m -60.03 149.54 73.79 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.083 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.72 78.07 1.37 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.509 2.139 . . . . 0.0 112.336 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.71 106.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.872 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.495 HG22 ' N ' ' A' ' 8' ' ' MET . 14.0 p -125.84 159.28 34.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.148 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.495 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -131.53 -175.62 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.816 -179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' C ' ' A' ' 161' ' ' ASP . 3.7 p -155.03 139.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.263 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.465 HG22 ' CE1' ' A' ' 163' ' ' PHE . 39.8 t -66.55 146.09 13.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.665 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -124.01 -167.21 12.69 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.49 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 11.0 mt-10 -62.58 149.84 87.63 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.628 0.251 . . . . 0.0 110.832 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 3.1 Cg_endo -83.01 136.08 7.86 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.848 2.365 . . . . 0.0 112.399 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -166.06 142.89 5.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.301 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.752 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.9 OUTLIER -117.95 173.46 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.026 0.441 . . . . 0.0 111.409 -179.639 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.62 ' HE2' HD13 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -59.27 -44.21 92.46 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.005 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.831 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 60.13 102.45 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.436 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -154.12 -44.69 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.567 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 62.77 20.51 12.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.66 0.267 . . . . 0.0 110.978 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.496 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 55.54 -173.95 0.05 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.822 0.344 . . . . 0.0 111.047 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -121.57 152.32 16.84 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.47 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -84.1 -31.08 25.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.795 0.331 . . . . 0.0 110.912 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -88.14 7.05 33.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.427 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -67.85 -67.97 0.42 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.809 0.337 . . . . 0.0 110.921 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' HB2' ' CE2' ' A' ' 102' ' ' PHE . 2.9 tp10 -110.83 176.06 5.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.907 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.97 136.89 40.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.1 mp -111.96 165.06 12.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.874 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.759 HG21 HD21 ' A' ' 88' ' ' LEU . 6.5 pt -62.94 135.19 27.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -99.24 106.87 19.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.741 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD2' HD11 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -83.64 101.83 11.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.471 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.461 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -145.47 163.03 35.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.986 -179.696 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -86.59 150.9 23.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.931 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -98.31 -31.37 12.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.936 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.1 m 60.26 31.66 20.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.861 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.31 -73.09 0.49 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 73' ' ' ARG . 5.2 m-85 64.17 -78.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.983 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -74.94 111.49 10.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.894 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -175.09 99.74 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.481 ' HB3' ' HE1' ' A' ' 69' ' ' HIS . . . 60.57 -169.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.066 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -61.81 84.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.85 -76.05 1.24 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.463 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.7 mm -82.42 119.23 31.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.893 0.377 . . . . 0.0 110.886 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 60.69 -176.46 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.8 114.82 17.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -103.67 81.26 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.843 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 64.06 127.26 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.532 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.4 -87.1 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.469 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.73 136.59 38.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.803 0.335 . . . . 0.0 110.962 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 145.46 45.41 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.488 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 161.33 -154.87 25.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.386 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -103.01 -36.45 8.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.92 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 7.3 mtt -75.04 168.32 20.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.02 -62.52 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.511 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 17.3 m 60.46 35.6 20.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.811 0.338 . . . . 0.0 110.889 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -154.55 163.39 31.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.441 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 106.16 116.33 4.15 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.547 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.24 89.52 4.79 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 120.667 0.27 . . . . 0.0 110.9 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.38 165.64 26.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.513 2.142 . . . . 0.0 112.175 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 58.36 29.82 18.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.767 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.454 HG21 ' CD2' ' A' ' 69' ' ' HIS . 2.9 tp -103.02 135.66 19.36 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.452 ' HD2' HD12 ' A' ' 60' ' ' ILE . 19.3 Cg_endo -59.88 125.92 19.01 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.408 2.072 . . . . 0.0 111.891 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.55 149.01 21.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.114 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 7.4 t -58.22 137.39 57.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.705 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.448 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -61.06 114.76 3.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.266 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.47 28.38 39.91 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.914 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -135.54 -178.86 5.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.837 0.351 . . . . 0.0 110.96 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -107.9 -28.79 9.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.691 179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.26 -165.94 1.17 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.703 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.481 ' HE1' ' HB3' ' A' ' 39' ' ' ALA . 7.4 p80 -110.76 154.56 23.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 70' ' ' ILE . 5.7 mm -66.92 153.72 8.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.404 ' N ' ' CG2' ' A' ' 70' ' ' ILE . 0.4 OUTLIER -168.83 33.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.783 -179.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -109.38 -178.97 3.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.86 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 36' ' ' PHE . 0.0 OUTLIER -95.13 -35.73 11.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.024 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.582 ' O ' HD13 ' A' ' 75' ' ' ILE . 1.9 m-85 -105.03 115.68 30.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.055 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 74' ' ' PHE . 44.1 mm -133.62 153.88 37.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.229 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.9 mp -113.18 107.93 16.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.278 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -90.77 123.21 34.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.043 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.725 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.48 162.19 35.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.051 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.65 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.4 OUTLIER 57.85 35.47 25.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.067 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.47 40.76 10.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.02 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.45 171.13 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -93.2 117.92 30.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.945 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.65 ' NE1' HD12 ' A' ' 79' ' ' LEU . 73.5 m95 -109.72 125.41 52.63 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.791 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.26 176.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.957 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -80.01 -42.01 24.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -91.13 -15.56 29.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.113 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.5 m -96.74 26.16 4.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.734 0.302 . . . . 0.0 111.083 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.759 HD21 HG21 ' A' ' 28' ' ' ILE . 2.8 tp -124.06 29.55 6.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.998 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.45 152.21 20.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.846 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.16 147.03 52.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.805 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.4 m -66.56 -29.61 69.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.032 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -106.13 -58.38 1.92 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 17.0 m -59.92 -37.67 80.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 58.0 22.58 9.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.028 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 5.4 m -87.01 155.9 55.12 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.151 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.21 118.94 5.75 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.513 2.142 . . . . 0.0 112.339 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.457 HD23 ' SG ' ' A' ' 101' ' ' CYS . 8.8 mp -101.81 70.69 1.26 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.879 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.89 35.19 1.75 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.108 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.545 ' C ' HD11 ' A' ' 28' ' ' ILE . 31.2 mm-40 -152.42 -48.51 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -149.41 157.76 43.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.909 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HD23 ' A' ' 97' ' ' LEU . 20.0 t -157.02 128.0 6.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.953 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.439 ' CE2' ' HB2' ' A' ' 25' ' ' GLU . 1.9 m-85 -98.45 171.96 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.562 ' HB2' HD22 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -155.59 140.43 17.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.874 179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -153.64 124.0 7.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.818 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.34 -122.84 15.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.536 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -113.07 36.08 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.899 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.24 165.53 29.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.855 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.527 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.3 p -117.07 116.0 50.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -116.13 159.38 21.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.865 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.403 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.7 p -100.92 176.76 5.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.793 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.419 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.16 -29.44 48.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.332 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.79 -58.05 9.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.326 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 p30 -71.27 -20.89 62.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.293 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.496 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 5.9 t80 -65.67 -30.11 70.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 111.144 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 20' ' ' PHE . 4.0 m-85 -79.08 -44.44 22.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.1 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.0 ttpt -79.26 -41.8 27.35 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.212 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -83.02 -55.72 4.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.259 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -96.99 37.07 1.34 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.914 0.387 . . . . 0.0 111.139 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -156.45 -167.38 17.66 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.455 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.612 HG21 ' SD ' ' A' ' 16' ' ' MET . 2.4 m -59.79 150.05 29.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.786 0.327 . . . . 0.0 110.902 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.2 OUTLIER -153.65 175.5 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.882 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.614 ' HB2' HD11 ' A' ' 129' ' ' ILE . 47.2 t -88.0 132.1 34.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.992 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -98.4 27.45 4.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.037 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.87 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -55.34 1.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.964 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 23.7 p -111.16 -17.44 13.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.169 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 66.45 73.68 0.36 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.873 0.368 . . . . 0.0 110.882 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.453 ' CB ' ' CE1' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -127.97 -163.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.731 179.964 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -111.34 97.0 0.92 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.734 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.701 HG22 HD11 ' A' ' 15' ' ' LEU . 1.7 mt -82.03 129.31 64.85 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.426 0.155 . . . . 0.0 110.63 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.644 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 77.5 Cg_exo -48.5 173.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.281 1.987 . . . . 0.0 112.337 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 73.1 Cg_endo -77.48 -47.54 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.558 2.172 . . . . 0.0 113.892 -179.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.831 HG23 ' HA3' ' A' ' 17' ' ' GLY . 1.2 m -126.22 21.85 7.29 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -178.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.644 ' HB3' ' HB2' ' A' ' 130' ' ' PRO . 0.7 OUTLIER -56.18 -171.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.539 179.641 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.766 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -121.02 108.3 22.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.782 0.325 . . . . 0.0 110.554 179.589 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.752 HG12 ' HG ' ' A' ' 15' ' ' LEU . 13.6 p -157.41 156.06 4.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.276 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.45 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.68 139.24 33.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.59 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.85 129.43 53.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.92 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -64.41 96.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.515 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.45 -88.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.857 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 138' ' ' ALA . 0.7 OUTLIER -88.8 -42.15 12.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.991 -1.004 . . . . 0.0 112.53 -177.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 5.2 m-85 -99.58 166.34 11.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.052 0.453 . . . . 0.0 112.12 -178.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.1 p -105.17 147.48 10.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.633 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.87 ' CE2' ' HB2' ' A' ' 124' ' ' ALA . 17.8 m-85 -132.62 142.59 49.19 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.881 0.372 . . . . 0.0 111.353 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.453 ' CE1' ' CB ' ' A' ' 127' ' ' LEU . 66.4 m80 -70.4 145.08 51.33 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.02 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.766 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.2 OUTLIER -64.97 -17.74 64.66 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.228 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 2.0 m170 -88.48 -46.48 9.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.544 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 144' ' ' HIS . 2.5 p -84.83 -33.73 22.83 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.806 ' CE1' HD21 ' A' ' 171' ' ' LEU . 36.8 t80 -56.99 99.98 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.88 0.371 . . . . 0.0 110.972 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -155.0 -177.01 6.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.108 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.82 150.01 26.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.943 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.836 HG13 ' O ' ' A' ' 171' ' ' LEU . 23.7 m -70.44 -30.56 43.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.154 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.784 HG23 HG23 ' A' ' 151' ' ' VAL . 19.8 t -106.99 -51.5 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.125 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 42.5 m -66.05 -28.14 68.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.914 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 24.0 mttp 54.84 39.62 31.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.03 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -127.84 141.83 51.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.907 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.497 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.8 mt-30 -61.93 166.2 4.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.898 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.714 HD22 ' N ' ' A' ' 157' ' ' LEU . 0.8 OUTLIER -122.44 172.21 8.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.08 164.61 31.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.07 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.0 t -47.16 128.82 12.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.317 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 102.85 -27.08 21.79 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.529 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.469 ' C ' HG23 ' A' ' 9' ' ' VAL . 8.7 m-20 -66.35 128.91 38.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.631 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -90.48 117.34 29.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.13 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.687 ' CD2' HD23 ' A' ' 171' ' ' LEU . 6.0 p90 -133.75 168.27 19.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.848 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.696 ' HB2' HG13 ' A' ' 172' ' ' VAL . 61.4 m-85 -114.71 171.03 7.89 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.768 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.71 123.2 30.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.805 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 10.2 mmt -83.13 168.74 16.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.971 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -59.75 -28.49 67.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.012 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -97.35 28.16 3.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.1 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.38 38.53 28.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.43 141.73 28.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.916 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.836 ' O ' HG13 ' A' ' 151' ' ' VAL . 0.3 OUTLIER -90.31 125.08 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.967 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.696 HG13 ' HB2' ' A' ' 164' ' ' TYR . 12.3 p -145.11 130.24 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.06 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 30.6 p -83.46 -173.44 4.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.023 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -61.08 2.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -57.08 -23.56 47.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.366 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.695 ' HB3' HG23 ' A' ' 172' ' ' VAL . 85.4 m-20 -89.98 -23.38 21.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.063 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.502 ' CD1' ' CD2' ' A' ' 164' ' ' TYR . 6.1 t80 -54.54 -66.03 0.47 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.839 0.352 . . . . 0.0 111.045 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -55.56 -26.18 42.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.119 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 72.4 m -82.02 -27.66 32.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.12 -20.69 18.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.387 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.72 -178.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.82 0.343 . . . . 0.0 110.874 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.869 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.5 m . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.76 0.314 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.5 p -104.73 107.89 19.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -72.49 -176.11 1.81 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.897 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.718 HG12 HG11 ' A' ' 7' ' ' VAL . 18.6 m -139.67 81.94 18.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.214 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.47 -41.47 3.35 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.57 2.18 . . . . 0.0 112.312 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -157.26 37.7 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.894 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.718 HG11 HG12 ' A' ' 4' ' ' VAL . 13.4 p -100.93 158.9 3.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.153 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.483 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -155.95 -177.95 6.95 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.595 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.471 HG23 ' C ' ' A' ' 161' ' ' ASP . 6.2 p -155.1 131.84 2.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.276 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.51 HG23 ' CD1' ' A' ' 163' ' ' PHE . 52.9 t -55.41 146.16 4.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.558 179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.464 ' C ' HG23 ' A' ' 159' ' ' THR . . . -128.09 -151.86 7.68 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.739 -179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -73.69 128.24 87.24 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.473 0.177 . . . . 0.0 110.735 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.7 ' HB2' HG12 ' A' ' 134' ' ' VAL . 33.5 Cg_exo -55.94 151.17 42.75 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.27 1.98 . . . . 0.0 112.342 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -166.04 149.75 7.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.36 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.659 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.0 OUTLIER -144.07 173.49 11.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.995 0.426 . . . . 0.0 111.225 -179.471 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.402 ' HE1' ' HB ' ' A' ' 120' ' ' THR . 0.0 OUTLIER -57.17 -52.94 63.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.767 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.588 ' CA ' HG23 ' A' ' 132' ' ' THR . . . 59.18 83.24 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.457 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -167.15 -43.55 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.519 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 63.45 27.3 15.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 0.0 110.774 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.508 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.3 OUTLIER 61.23 -170.19 0.16 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.839 -179.983 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -145.05 150.26 22.44 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.522 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.739 ' HB3' HD22 ' A' ' 27' ' ' LEU . 40.0 m-20 -83.91 -42.69 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.866 0.365 . . . . 0.0 110.965 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.87 -29.15 68.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -58.29 -74.93 0.05 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.949 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG2' ' CG ' ' A' ' 102' ' ' PHE . 30.5 tp10 -72.92 163.44 28.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.958 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -76.0 99.94 4.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.839 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 22' ' ' ASP . 2.0 tp -77.38 163.25 26.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.906 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.966 HG21 HD21 ' A' ' 88' ' ' LEU . 6.7 pt -62.86 149.28 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.198 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 m -107.78 106.85 17.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.794 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.38 101.78 12.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.393 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.4 OUTLIER -150.3 166.1 31.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.936 -179.776 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -89.73 151.55 21.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -94.27 -178.57 4.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.855 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 34' ' ' THR . 28.8 m -133.29 35.65 3.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.888 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -97.49 -74.43 0.57 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.879 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER 68.06 -69.64 0.14 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -105.7 83.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.885 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.523 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . . . -131.15 79.1 1.87 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.704 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . . . 60.61 107.8 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.06 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.15 79.27 0.24 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.931 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.39 -126.24 0.79 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.462 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.632 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.5 mp -84.12 -72.17 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.349 . . . . 0.0 110.885 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.7 171.02 3.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 60.5 80.09 0.22 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.855 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -100.74 80.53 2.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.834 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.53 130.54 10.27 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.553 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -90.34 107.66 3.47 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.515 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 m -66.31 98.56 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.868 0.366 . . . . 0.0 110.904 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 136.58 137.34 3.64 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.533 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 98.93 -28.68 14.08 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.508 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -158.47 -45.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.846 0.355 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.5 mtm -87.27 -178.14 6.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.83 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -100.88 -168.57 28.42 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.513 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -106.67 -170.06 1.66 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.909 0.385 . . . . 0.0 110.849 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 140.64 142.9 4.23 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.499 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 178.13 -160.8 27.27 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.512 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.51 83.0 10.37 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.701 0.286 . . . . 0.0 110.948 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.76 165.38 1.17 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.493 2.129 . . . . 0.0 112.195 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 58.64 30.66 20.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.893 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.521 HD13 ' CD2' ' A' ' 69' ' ' HIS . 8.3 tt -107.95 136.24 19.77 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.995 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HD2' HG13 ' A' ' 60' ' ' ILE . 19.6 Cg_endo -61.57 125.95 17.96 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.288 1.992 . . . . 0.0 111.98 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.6 157.72 15.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.177 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.404 ' HB2' HG12 ' A' ' 70' ' ' ILE . 4.9 t -58.26 142.49 47.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.494 ' HB3' ' HA ' ' A' ' 83' ' ' TRP . . . -62.9 114.75 3.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.27 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.72 28.53 46.55 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.997 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.43 -178.92 5.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.854 0.359 . . . . 0.0 110.944 -179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -109.19 -29.31 8.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.83 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -104.67 -165.67 1.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.847 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.704 ' CE1' ' HB3' ' A' ' 39' ' ' ALA . 3.7 p80 -106.6 173.42 6.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.986 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.561 ' C ' HD23 ' A' ' 71' ' ' LEU . 8.3 mm -92.05 153.81 3.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.196 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.561 HD23 ' C ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -165.8 31.65 0.05 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.806 -179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.33 -178.96 3.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.459 HH22 HD11 ' A' ' 42' ' ' ILE . 0.0 OUTLIER -96.23 -36.15 11.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.002 -179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.547 ' O ' HD13 ' A' ' 75' ' ' ILE . 2.3 m-85 -106.72 116.66 32.32 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.547 HD13 ' O ' ' A' ' 74' ' ' PHE . 41.9 mm -134.41 154.02 36.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.284 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.6 mp -112.81 108.95 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.291 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.71 123.3 34.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.1 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.711 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -158.32 161.06 37.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.055 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.79 HD12 ' CZ2' ' A' ' 83' ' ' TRP . 0.2 OUTLIER 57.59 35.83 26.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.017 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 62.63 35.81 14.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.82 168.94 5.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' A' ' 82' ' ' HIS . 41.6 p-80 -94.21 117.95 30.85 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.925 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.79 ' CZ2' HD12 ' A' ' 79' ' ' LEU . 56.2 m95 -110.08 127.23 54.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.709 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -51.9 175.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.116 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.1 t -80.05 -39.26 30.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.651 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -91.06 -34.67 15.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 9.3 m -71.43 -28.4 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.916 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.966 HD21 HG21 ' A' ' 28' ' ' ILE . 57.7 tp -74.56 81.12 1.98 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.884 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.0 mttt -147.3 162.35 39.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.874 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.96 147.03 48.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -29.95 60.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.134 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.57 -63.01 1.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.967 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.497 ' HB2' HG22 ' A' ' 95' ' ' VAL . 19.4 m -59.31 -32.7 70.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.032 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 56.35 23.03 6.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.151 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.497 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.6 m -88.09 147.39 40.49 Favored Pre-proline 0 N--CA 1.452 -0.326 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.143 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.39 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.503 2.135 . . . . 0.0 112.286 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.4 mp -108.99 65.0 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.741 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.98 30.56 3.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.165 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.666 ' C ' HD11 ' A' ' 28' ' ' ILE . 25.5 mm-40 -140.47 -49.64 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.766 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.59 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -139.21 167.37 22.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.819 179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.661 ' HB2' HG23 ' A' ' 28' ' ' ILE . 9.0 t -157.0 127.96 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.984 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.481 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.5 OUTLIER -113.07 156.17 23.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.808 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.4 p -145.33 127.39 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.966 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -149.1 123.99 9.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.18 -92.47 1.81 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.477 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -157.78 36.08 0.26 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.805 0.336 . . . . 0.0 110.838 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.1 m -154.82 152.16 29.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.876 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.537 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.3 p -84.15 115.99 27.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.064 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -118.84 158.13 26.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.536 ' HB3' HD21 ' A' ' 97' ' ' LEU . 30.2 p -99.93 171.7 7.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.691 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.04 -32.61 51.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.347 -179.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 3.7 t0 -51.53 -58.11 7.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.43 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 40.8 p30 -73.33 -20.68 60.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.328 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.508 ' CE1' ' CZ ' ' A' ' 20' ' ' PHE . 8.5 t80 -62.32 -31.53 72.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.864 0.364 . . . . 0.0 110.815 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.3 m-85 -74.22 -35.26 63.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.755 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.1 mttt -85.09 -55.56 3.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.148 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -71.55 -48.26 49.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.348 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 114' ' ' PHE . 5.4 m-85 -103.27 37.07 2.07 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.872 0.368 . . . . 0.0 111.087 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -157.74 173.13 35.07 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.585 HG22 ' CG1' ' A' ' 142' ' ' VAL . 0.2 OUTLIER -59.06 155.03 14.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.717 0.294 . . . . 0.0 110.895 -180.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.408 ' C ' HD11 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -166.15 160.14 15.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.035 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.409 ' N ' HD11 ' A' ' 129' ' ' ILE . 49.6 t -57.9 136.91 57.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.19 19.69 5.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.296 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.3 -48.29 1.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.827 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 1.8 m -111.02 -15.24 13.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.139 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 65.3 29.89 11.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.916 0.389 . . . . 0.0 110.627 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 7.9 tp -82.62 136.08 34.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.765 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -55.69 99.96 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.731 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.409 HD11 ' N ' ' A' ' 122' ' ' CYS . 46.1 mt -63.37 128.55 92.65 Favored Pre-proline 0 C--N 1.33 -0.281 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.476 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 88.1 Cg_exo -44.22 169.97 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.547 2.165 . . . . 0.0 112.691 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.07 -47.03 0.14 Allowed 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.622 2.214 . . . . 0.0 113.987 -178.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.588 HG23 ' CA ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.11 21.41 8.09 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.659 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.6 146.63 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 179.208 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.7 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -90.56 110.64 22.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.9 0.381 . . . . 0.0 111.422 -179.451 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.709 HG23 ' HG ' ' A' ' 145' ' ' LEU . 9.7 p -150.2 163.36 3.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.03 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.486 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 147.14 24.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.554 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.0 129.65 56.76 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.868 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.78 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -64.66 96.52 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.599 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.484 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.3 OUTLIER 56.97 -85.95 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.429 0.633 . . . . 0.0 111.686 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.404 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.0 m-20 -101.99 -48.75 4.15 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.032 -0.986 . . . . 0.0 111.776 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -82.06 160.6 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.725 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.585 ' CG1' HG22 ' A' ' 120' ' ' THR . 10.4 p -106.23 153.46 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.58 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -132.66 173.12 11.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.125 0.488 . . . . 0.0 111.389 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.433 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -70.82 163.15 27.9 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.904 179.817 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.709 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -79.8 -31.04 40.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.166 0.507 . . . . 0.0 109.741 178.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.25 -49.19 6.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.815 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.433 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 71.4 m -49.9 -38.04 34.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.318 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.786 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.5 OUTLIER -56.97 112.43 1.33 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.949 0.404 . . . . 0.0 111.046 -179.692 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.06 171.73 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.95 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -75.77 149.98 37.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.93 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 152' ' ' VAL . 9.9 m -75.55 -32.06 24.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.074 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.688 HG23 HG23 ' A' ' 151' ' ' VAL . 21.5 t -103.29 -49.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.071 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.13 -28.03 65.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.914 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt 59.04 41.98 19.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.008 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -129.07 141.15 51.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.995 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -64.11 151.19 43.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.982 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.678 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.7 mm? -104.47 162.71 13.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.689 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -145.96 171.26 15.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.311 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.464 HG23 ' C ' ' A' ' 11' ' ' GLY . 4.9 m -43.98 125.32 4.27 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.609 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.14 -22.49 38.23 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.769 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.471 ' C ' HG23 ' A' ' 9' ' ' VAL . 2.6 t0 -68.55 131.3 45.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.772 0.32 . . . . 0.0 110.778 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.44 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.5 mt-10 -87.88 128.45 35.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.008 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.884 ' CD2' HD23 ' A' ' 171' ' ' LEU . 8.3 p90 -145.03 140.56 28.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.127 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.687 ' HB2' HG13 ' A' ' 172' ' ' VAL . 54.1 m-85 -98.09 132.49 43.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.556 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.78 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.9 tp -87.96 111.0 21.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.86 0.362 . . . . 0.0 110.839 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.5 mmt -74.77 148.76 40.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.901 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -59.72 -28.06 67.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.056 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -97.58 34.6 1.81 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 60.5 p 53.53 80.11 0.11 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.432 ' HD3' HG11 ' A' ' 151' ' ' VAL . 0.0 OUTLIER -156.17 130.63 8.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.811 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.884 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.6 mp -92.5 128.77 38.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.958 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.687 HG13 ' HB2' ' A' ' 164' ' ' TYR . 6.6 p -144.99 118.84 2.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 31.2 p -66.56 -172.87 0.18 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.656 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 7.9 mttm -77.15 -39.26 49.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.355 -179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.11 -59.04 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.521 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -74.22 -9.33 58.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.501 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 8.6 t80 -57.05 -66.13 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 110.863 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -63.87 -28.59 69.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.009 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.0 m -77.77 -21.72 51.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.223 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -96.16 -29.85 13.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.774 0.321 . . . . 0.0 111.149 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . 0.428 ' HE2' ' CE1' ' A' ' 177' ' ' TYR . 0.1 OUTLIER -170.35 -178.22 2.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.936 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 179.999 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.891 0.377 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.67 161.49 37.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.939 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 60.76 111.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.865 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.0 m -124.01 152.36 66.64 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.128 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.5 -46.25 1.41 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.519 2.146 . . . . 0.0 112.356 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 t0 60.41 176.21 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.833 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.458 ' HB ' ' CE1' ' A' ' 164' ' ' TYR . 9.1 p -110.24 126.92 67.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.489 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.421 ' HE3' ' HB2' ' A' ' 8' ' ' MET . 0.0 OUTLIER -131.76 -163.06 1.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.423 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 162' ' ' GLU . 9.8 p -147.58 132.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.406 ' CG2' ' CD1' ' A' ' 163' ' ' PHE . 21.6 t -55.58 146.19 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.224 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.418 ' C ' HG23 ' A' ' 159' ' ' THR . . . -124.33 -174.77 14.16 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.371 -0.919 . . . . 0.0 112.908 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 50.9 mt-10 -56.64 137.39 77.49 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.558 0.218 . . . . 0.0 110.935 -179.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.802 ' HB2' HG12 ' A' ' 134' ' ' VAL . 14.7 Cg_exo -67.01 136.99 43.03 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.498 2.132 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.417 ' N ' ' O ' ' A' ' 135' ' ' VAL . 0.7 OUTLIER -166.07 142.97 5.22 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.113 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.959 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.6 OUTLIER -116.28 173.89 6.35 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 111.443 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.44 ' HE2' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -68.36 -38.74 81.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.669 -179.223 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 71.67 55.72 7.22 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.336 -0.935 . . . . 0.0 111.975 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -93.04 23.24 30.28 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.804 -0.713 . . . . 0.0 113.042 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -51.07 95.04 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.868 0.366 . . . . 0.0 110.738 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.52 ' CE2' ' CD2' ' A' ' 114' ' ' PHE . 3.1 m-85 -57.79 -35.25 70.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.828 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.07 176.12 43.43 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.485 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.756 ' HB3' HD22 ' A' ' 27' ' ' LEU . 74.1 m-20 -83.99 -30.79 25.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.844 0.354 . . . . 0.0 110.965 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.17 -31.83 73.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.66 -76.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.953 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 32.3 mm-40 -82.78 172.19 13.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.023 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.7 ptm85 -76.02 118.16 18.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.756 HD22 ' HB3' ' A' ' 22' ' ' ASP . 3.4 tp -95.71 165.15 12.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.939 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.995 HG21 HD21 ' A' ' 88' ' ' LEU . 6.4 pt -62.68 144.21 14.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.178 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.437 HG22 ' HG ' ' A' ' 31' ' ' LEU . 20.2 m -109.19 106.76 16.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -82.74 101.64 11.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.263 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -147.1 166.04 28.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.155 -179.563 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.03 145.45 44.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.849 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.484 ' ND2' HG21 ' A' ' 70' ' ' ILE . 1.1 t30 -95.02 -167.68 1.67 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.869 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.841 HG23 ' HB2' ' A' ' 38' ' ' ALA . 6.2 t -82.35 58.6 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.924 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 6.2 pm0 45.26 -169.41 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.569 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.401 ' CD2' ' O ' ' A' ' 71' ' ' LEU . 4.4 t80 -91.9 -22.9 19.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.013 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -57.61 -20.52 33.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.331 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.841 ' HB2' HG23 ' A' ' 34' ' ' THR . . . -46.43 -29.52 1.76 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.801 0.334 . . . . 0.0 111.479 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.56 ' CB ' HD22 ' A' ' 71' ' ' LEU . . . -125.93 -172.87 2.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.131 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -80.76 88.03 5.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -133.26 -43.66 0.14 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.541 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.7 tp -54.3 135.45 16.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.773 0.32 . . . . 0.0 111.402 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.25 87.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.847 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -165.76 -45.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.902 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -99.27 92.2 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.875 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 162.89 -131.16 2.41 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 139.31 -132.62 5.75 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.472 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.4 m -151.55 130.04 12.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.828 0.347 . . . . 0.0 110.894 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.25 61.75 1.31 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.507 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -88.87 -132.5 4.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.561 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -108.84 -33.66 6.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.842 0.353 . . . . 0.0 110.876 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 8.1 ptt? -168.83 -52.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.909 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.87 -161.1 28.62 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.442 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.1 m 60.35 102.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.793 0.33 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -105.37 -106.34 3.11 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.516 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 61.1 168.92 0.54 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.466 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 60' ' ' ILE . 0.2 OUTLIER -95.12 143.12 25.57 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.686 0.279 . . . . 0.0 110.86 179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.35 154.61 40.99 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.526 2.15 . . . . 0.0 112.352 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 57.27 28.9 15.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.923 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.636 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.4 tp -94.64 134.9 24.49 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.031 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 60' ' ' ILE . 13.3 Cg_endo -57.45 125.97 20.48 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.459 2.106 . . . . 0.0 111.981 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.01 146.8 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.148 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.9 t -57.1 155.29 8.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -80.08 114.71 19.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.565 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.38 -59.06 0.38 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.466 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 18.7 p -96.94 161.31 13.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.35 . . . . 0.0 110.902 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -91.8 75.62 5.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -178.15 134.0 0.15 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.896 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.636 ' CD2' HG21 ' A' ' 60' ' ' ILE . 7.1 p80 -63.94 153.4 37.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.484 HG21 ' ND2' ' A' ' 33' ' ' ASN . 10.3 mm -79.24 151.26 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.56 HD22 ' CB ' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -157.35 30.61 0.28 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.861 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -102.99 -178.98 3.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.96 -35.52 8.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.678 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -106.18 107.2 18.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.683 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.467 ' C ' HD12 ' A' ' 76' ' ' LEU . 37.4 mm -128.92 153.06 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 111.485 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD12 ' C ' ' A' ' 75' ' ' ILE . 6.1 mp -108.6 110.33 21.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.147 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -90.68 126.55 36.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.247 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.769 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.69 165.73 31.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.963 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.667 HD12 ' NE1' ' A' ' 83' ' ' TRP . 0.5 OUTLIER 57.07 34.63 25.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.108 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.87 40.18 9.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.088 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -177.53 169.03 2.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.943 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.411 ' O ' ' CD2' ' A' ' 82' ' ' HIS . 34.6 p-80 -88.8 120.97 30.69 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.896 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.667 ' NE1' HD12 ' A' ' 79' ' ' LEU . 55.2 m95 -111.7 128.24 56.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.85 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.46 ' CE1' ' CD1' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -53.83 167.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.854 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 t -73.3 -39.5 65.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.748 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.4 tttt -91.08 -37.42 13.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.19 -31.53 72.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.958 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.995 HD21 HG21 ' A' ' 28' ' ' ILE . 10.9 tp -65.97 85.75 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.945 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -156.1 161.38 40.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.922 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 147.04 40.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 1.1 m -69.41 -28.82 66.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.048 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -102.77 -60.19 1.59 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.124 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 20.9 m -58.69 -39.12 79.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.034 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 57.48 22.43 8.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.442 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.4 m -85.37 154.39 59.66 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.188 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.71 118.92 5.87 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.486 2.124 . . . . 0.0 112.204 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 95' ' ' VAL . 9.3 mp -111.12 57.88 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.728 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -95.2 43.19 1.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.175 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -157.43 -62.23 0.09 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.867 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.686 ' CB ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -130.99 128.97 41.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.731 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.448 ' CB ' HG23 ' A' ' 28' ' ' ILE . 11.0 t -129.89 127.91 41.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 25' ' ' GLU . 4.2 m-85 -111.48 171.94 7.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.731 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.498 ' HB3' HD22 ' A' ' 79' ' ' LEU . 11.7 p -149.5 137.24 20.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.906 0.384 . . . . 0.0 110.973 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -169.44 123.97 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.842 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.99 17.4 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.613 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 60.86 38.31 17.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.831 0.348 . . . . 0.0 110.935 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 15.0 m -156.18 156.29 33.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.862 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.9 p -78.0 120.72 29.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.118 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -124.79 151.56 45.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.944 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 24.4 p -103.32 169.2 8.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.436 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' O ' ' CD2' ' A' ' 115' ' ' PHE . 0.0 OUTLIER -78.06 -41.01 36.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.291 -179.653 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -43.53 -58.04 2.82 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.59 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -75.58 -20.49 58.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.52 ' CD2' ' CE2' ' A' ' 20' ' ' PHE . 56.0 t80 -64.32 -35.31 80.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.013 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.437 ' CD2' ' O ' ' A' ' 111' ' ' LYS . 33.4 m-85 -67.63 -44.69 77.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.036 0.446 . . . . 0.0 110.87 179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -80.49 -32.55 36.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.314 -179.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.2 mmt85 -80.82 -56.59 4.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.341 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.432 ' CG ' ' CE1' ' A' ' 114' ' ' PHE . 5.4 m-85 -95.48 -43.06 8.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.155 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -66.58 -150.64 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.292 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 89.3 m -103.18 154.05 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.68 0.276 . . . . 0.0 110.71 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.445 ' HA ' HD12 ' A' ' 129' ' ' ILE . 0.0 OUTLIER -137.23 179.36 6.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.903 0.383 . . . . 0.0 111.268 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 129' ' ' ILE . 49.8 t -78.85 141.73 37.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.079 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -91.15 20.3 5.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.438 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.15 -49.36 1.7 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.893 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 19.9 p -111.22 -17.66 13.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 67.35 47.09 1.33 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.956 0.408 . . . . 0.0 111.097 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.11 -162.08 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.58 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -117.33 79.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.903 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.499 HD11 ' CA ' ' A' ' 122' ' ' CYS . 2.1 mp -59.53 139.09 89.34 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.525 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 73.9 Cg_exo -46.84 172.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.248 1.965 . . . . 0.0 111.989 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.418 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 61.3 Cg_endo -77.13 -55.02 0.06 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.305 2.003 . . . . 0.0 113.798 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.84 22.17 9.76 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.474 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.959 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -57.55 -166.85 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.521 179.871 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.4 OUTLIER -122.77 111.68 31.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.967 0.413 . . . . 0.0 111.412 -179.672 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.753 HG23 ' HG ' ' A' ' 145' ' ' LEU . 14.1 p -148.74 162.72 5.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.493 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.522 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.02 137.97 34.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.897 0.38 . . . . 0.0 110.891 -179.832 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.65 173.09 6.45 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.748 -179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.669 ' HB3' ' CE1' ' A' ' 143' ' ' TYR . . . -142.21 134.4 27.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.931 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.876 ' CG ' HD13 ' A' ' 165' ' ' LEU . 0.0 OUTLIER 39.65 -84.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.609 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.548 ' N ' ' O ' ' A' ' 138' ' ' ALA . 10.7 t0 -144.33 41.08 1.35 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.815 0.34 . . . . 0.0 111.152 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.447 ' HB2' ' CE1' ' A' ' 143' ' ' TYR . 10.8 m-85 -148.11 165.05 32.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.48 ' O ' HG13 ' A' ' 142' ' ' VAL . 14.6 p -115.51 121.11 66.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.774 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.669 ' CE1' ' HB3' ' A' ' 138' ' ' ALA . 51.0 m-85 -113.61 140.1 48.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.015 0.436 . . . . 0.0 111.283 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 147' ' ' CYS . 3.3 m80 -58.87 150.4 24.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.802 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.753 ' HG ' HG23 ' A' ' 135' ' ' VAL . 0.6 OUTLIER -61.74 -21.92 64.94 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.179 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.19 -49.14 6.54 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.598 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.455 ' HB2' ' HB2' ' A' ' 144' ' ' HIS . 63.9 m -57.04 -40.77 77.42 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.916 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.779 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.2 OUTLIER -56.85 110.6 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.119 -179.698 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.15 172.8 4.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.795 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 33.7 t -82.13 150.25 27.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.208 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 152' ' ' VAL . 29.1 m -73.62 -31.89 33.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.304 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.68 HG23 HG23 ' A' ' 151' ' ' VAL . 20.5 t -99.46 -57.57 4.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.467 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 28.2 m -65.9 -28.11 68.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.104 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? 60.0 44.5 13.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.912 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.95 139.63 52.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.079 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.622 ' C ' HD22 ' A' ' 157' ' ' LEU . 10.9 mp0 -66.58 166.31 13.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.428 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.722 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.2 mm? -122.22 166.42 14.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.396 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -146.04 169.16 19.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.029 0.442 . . . . 0.0 111.472 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.434 HG23 ' N ' ' A' ' 12' ' ' GLU . 7.4 m -43.79 129.29 5.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.654 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 92.71 -21.36 39.37 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.882 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.45 ' OD1' HD12 ' A' ' 157' ' ' LEU . 6.9 t70 -73.91 130.96 40.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.835 0.35 . . . . 0.0 110.791 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.444 ' HA ' ' HA ' ' A' ' 9' ' ' VAL . 14.4 mt-10 -87.99 127.07 35.38 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.019 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.804 ' CD2' HD23 ' A' ' 171' ' ' LEU . 25.9 p90 -134.62 179.07 6.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.419 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.731 ' HB2' HG13 ' A' ' 172' ' ' VAL . 16.1 m-85 -133.08 115.04 14.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.333 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.876 HD13 ' CG ' ' A' ' 139' ' ' GLN . 5.9 tt -87.97 110.78 20.84 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 0.0 110.595 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . 0.428 ' HE2' HG11 ' A' ' 172' ' ' VAL . 18.4 mmt -75.96 164.33 26.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.015 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -57.24 -28.13 62.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.171 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -97.38 28.92 3.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.046 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 56.54 33.96 23.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.987 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.9 mtt85 -98.39 98.55 9.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.804 HD23 ' CD2' ' A' ' 163' ' ' PHE . 0.5 OUTLIER -66.97 133.11 49.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.788 179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.752 HG23 ' OD2' ' A' ' 176' ' ' ASP . 2.7 p -145.18 140.26 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 4.0 m -71.46 -178.43 2.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.965 0.412 . . . . 0.0 111.313 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.11 -31.15 22.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.885 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.61 -54.57 25.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.451 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.752 ' OD2' HG23 ' A' ' 172' ' ' VAL . 8.1 p-10 -83.0 4.15 27.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.648 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.524 ' CE1' ' CG ' ' A' ' 164' ' ' TYR . 27.9 t80 -61.77 -66.14 0.58 Allowed 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.08 0.467 . . . . 0.0 110.966 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.03 -28.78 0.74 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.826 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -31.53 57.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.367 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -97.1 -31.74 12.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.514 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 9.1 mmmm 64.42 174.28 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.868 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.839 0.352 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 t -70.94 106.25 3.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.936 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -151.23 31.63 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.885 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.429 ' O ' HG23 ' A' ' 4' ' ' VAL . 6.5 m -110.12 82.03 2.4 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.061 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.53 -37.59 7.15 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.547 2.165 . . . . 0.0 112.306 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -152.54 80.12 1.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.907 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 ' N ' ' A' ' 8' ' ' MET . 13.2 p -115.36 159.13 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.073 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.485 ' N ' HG22 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -145.08 179.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.605 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.467 HG23 ' C ' ' A' ' 161' ' ' ASP . 5.7 p -155.03 135.38 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.358 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.453 HG23 ' CD1' ' A' ' 163' ' ' PHE . 43.9 t -60.42 146.31 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.45 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.473 ' C ' HG23 ' A' ' 159' ' ' THR . . . -130.14 -160.72 10.18 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.777 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 4.5 mm-40 -64.0 132.02 95.14 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.579 0.228 . . . . 0.0 110.832 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.555 ' HB2' HG12 ' A' ' 134' ' ' VAL . 21.9 Cg_exo -63.16 143.64 90.48 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.311 2.008 . . . . 0.0 112.337 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -166.13 155.01 11.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.372 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.915 HD12 ' HG3' ' A' ' 133' ' ' GLN . 0.1 OUTLIER -144.09 173.88 11.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.138 0.494 . . . . 0.0 111.697 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.65 -68.38 0.24 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.144 -179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.701 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 85.49 63.32 1.57 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.268 -179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -109.45 -70.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.543 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.4 ' CA ' ' HB3' ' A' ' 131' ' ' PRO . 4.2 tt0 72.42 84.01 0.13 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.908 0.385 . . . . 0.0 110.793 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.483 ' CE2' ' CE1' ' A' ' 114' ' ' PHE . 0.4 OUTLIER -57.28 -167.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.926 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -177.51 179.69 48.08 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.581 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.635 ' HB3' HD22 ' A' ' 27' ' ' LEU . 11.6 m-20 -81.32 -30.03 34.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.816 0.341 . . . . 0.0 110.955 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -58.26 -26.26 62.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.137 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -56.99 -68.56 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.076 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' HG3' ' CE1' ' A' ' 102' ' ' PHE . 6.5 mm-40 -103.42 176.02 5.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.939 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.92 121.8 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 22' ' ' ASP . 1.0 OUTLIER -95.65 162.08 13.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.844 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.804 HD11 ' C ' ' A' ' 99' ' ' GLU . 7.4 pt -62.84 158.28 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.125 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 43.9 m -123.8 106.95 10.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.827 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.04 101.86 6.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -144.68 162.22 37.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' CE1' ' A' ' 74' ' ' PHE . 6.3 mp0 -81.61 156.99 24.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.892 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.464 ' ND2' HG21 ' A' ' 70' ' ' ILE . 3.4 m-20 -107.5 171.85 7.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.2 t -97.89 37.66 1.38 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.898 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -127.02 163.09 24.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.889 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -169.76 -42.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.882 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -142.08 80.26 1.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.965 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -143.55 93.42 2.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.139 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 60.6 107.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.069 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.2 79.32 0.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.861 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -107.96 -115.57 3.93 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.523 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.401 ' O ' HG22 ' A' ' 42' ' ' ILE . 41.8 mm -82.3 80.56 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.825 0.345 . . . . 0.0 110.963 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 60.33 110.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.866 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -176.58 87.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -102.8 97.42 7.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.902 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.06 111.62 3.91 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.479 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 59.99 95.55 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.467 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.8 p -104.57 159.92 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.874 0.369 . . . . 0.0 110.905 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.75 -58.76 0.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.508 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.57 169.76 43.93 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.477 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.15 -37.73 88.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.852 0.358 . . . . 0.0 110.935 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.6 ptp -169.45 81.45 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.881 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -71.45 -44.95 49.58 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.475 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.3 t -146.29 93.02 2.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.795 0.331 . . . . 0.0 110.857 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 144.3 -145.6 15.3 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.488 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.55 117.44 0.53 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.579 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.93 83.01 65.07 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 110.929 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.99 168.73 0.78 Allowed 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.546 2.164 . . . . 0.0 112.232 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 57.88 30.25 18.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.879 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.662 HD13 ' CD2' ' A' ' 69' ' ' HIS . 8.8 tt -105.01 136.65 19.13 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.975 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.71 125.88 20.54 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.351 2.034 . . . . 0.0 111.799 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.87 134.51 38.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.262 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.433 ' HB2' HG12 ' A' ' 70' ' ' ILE . 3.2 t -59.27 141.82 53.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.774 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE2' ' A' ' 83' ' ' TRP . . . -63.38 114.84 4.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.132 179.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.91 26.37 45.57 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.025 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -128.67 -178.88 4.77 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.798 0.333 . . . . 0.0 110.832 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -134.99 35.61 3.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.951 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' CG ' ' CE1' ' A' ' 69' ' ' HIS . 16.2 tt0 -151.7 -88.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.662 ' CD2' HD13 ' A' ' 60' ' ' ILE . 1.5 p80 175.75 -179.18 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.758 0.313 . . . . 0.0 110.958 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.464 HG21 ' ND2' ' A' ' 33' ' ' ASN . 3.2 mm -103.33 150.88 6.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.022 0.439 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -176.83 37.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.85 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -109.38 170.35 8.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.912 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.45 -70.05 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.902 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.429 ' CE1' ' HG3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -90.3 140.23 29.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.042 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.7 mm -141.56 151.24 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.16 106.96 17.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.496 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -90.83 115.48 27.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.978 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -152.71 167.03 30.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.794 HD21 ' SG ' ' A' ' 101' ' ' CYS . 1.6 mt 57.5 35.34 25.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 62.59 35.52 14.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.032 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -172.47 176.11 3.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.027 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.45 ' CD2' HG13 ' A' ' 70' ' ' ILE . 48.7 p-80 -95.43 117.95 31.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.706 ' CB ' HD13 ' A' ' 88' ' ' LEU . 61.5 m95 -110.72 125.79 53.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.731 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.93 175.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.8 t -80.01 -40.55 27.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.484 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -91.12 -19.71 22.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 5.2 m -92.27 17.65 9.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.306 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.706 HD13 ' CB ' ' A' ' 83' ' ' TRP . 10.2 tp -127.93 73.59 1.47 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.9 0.381 . . . . 0.0 110.842 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 12.9 mmtt -127.26 150.49 49.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 14.1 t -60.48 126.42 27.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.799 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 2.4 m -58.48 -20.8 48.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.472 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -102.87 -63.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.765 0.317 . . . . 0.0 111.347 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 95' ' ' VAL . 21.8 m -68.98 -30.18 68.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.25 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.401 ' O ' ' CD2' ' A' ' 94' ' ' HIS . 15.0 t-160 57.87 22.35 8.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.028 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.562 HG22 ' HB2' ' A' ' 93' ' ' CYS . 4.9 m -87.23 152.21 52.45 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.177 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.93 118.97 5.92 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.51 2.14 . . . . 0.0 112.24 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.58 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.3 mp -113.17 56.41 0.68 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.42 28.62 3.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.202 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.804 ' C ' HD11 ' A' ' 28' ' ' ILE . 3.4 mm-40 -135.09 -46.54 0.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.781 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.9 mtm180 -148.75 138.02 21.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.804 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.794 ' SG ' HD21 ' A' ' 79' ' ' LEU . 53.5 t -112.96 156.02 23.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.453 ' CD2' ' HG3' ' A' ' 111' ' ' LYS . 1.9 t80 -158.14 120.72 3.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.804 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 11.4 t -112.93 152.96 28.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.952 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -151.75 123.95 8.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.913 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 68.56 -104.99 1.32 Allowed Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.443 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.58 -67.72 0.89 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.788 0.327 . . . . 0.0 110.825 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.7 m -70.08 -176.97 1.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.534 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.5 p -110.57 116.0 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.096 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -113.86 120.9 42.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.837 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.447 ' HB3' HD21 ' A' ' 97' ' ' LEU . 31.4 p -63.98 173.99 1.66 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.847 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.453 ' HG3' ' CD2' ' A' ' 102' ' ' PHE . 0.0 OUTLIER -78.06 -30.0 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.442 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 22.6 t0 -53.33 -58.01 8.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.312 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -71.93 -20.72 61.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.079 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.483 ' CE1' ' CE2' ' A' ' 20' ' ' PHE . 8.6 t80 -62.04 -27.22 68.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.847 0.356 . . . . 0.0 110.923 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 2.3 m-85 -79.15 -44.56 21.71 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt -85.41 -62.39 1.54 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.466 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 27.8 mmt180 -58.16 -52.09 67.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.762 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 7.3 m-85 -88.46 -43.03 11.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.347 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.41 -159.9 17.86 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.416 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.7 m -103.09 142.92 33.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.786 0.327 . . . . 0.0 110.827 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.6 173.87 11.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.074 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 51.1 t -65.2 138.18 58.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -94.55 29.59 2.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.122 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.18 -58.14 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.923 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 10.3 p -109.9 8.03 24.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.325 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 6.7 mp0 57.96 29.86 18.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.815 0.34 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.3 tp -87.55 143.82 27.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.787 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.65 103.69 1.24 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.698 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.608 ' CG2' HD11 ' A' ' 15' ' ' LEU . 53.8 mt -60.76 134.34 92.18 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.5 0.19 . . . . 0.0 110.489 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.515 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 80.4 Cg_exo -45.99 172.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.507 2.138 . . . . 0.0 112.54 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.4 ' HB3' ' CA ' ' A' ' 19' ' ' GLU . 7.3 Cg_exo -73.72 -55.37 0.09 OUTLIER 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.856 2.37 . . . . 0.0 113.393 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.701 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.8 OUTLIER -126.14 22.05 7.31 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.617 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.915 ' HG3' HD12 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -53.57 -178.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.492 179.836 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.555 HG12 ' HB2' ' A' ' 13' ' ' PRO . 0.2 OUTLIER -121.52 111.96 33.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.908 0.385 . . . . 0.0 111.123 -179.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.713 HG23 ' HG ' ' A' ' 145' ' ' LEU . 7.1 p -157.09 164.29 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.952 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.505 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.59 138.18 34.54 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.493 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 142' ' ' VAL . 0.0 OUTLIER -104.72 130.08 52.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.785 -179.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.435 ' O ' ' N ' ' A' ' 140' ' ' ASP . . . -64.86 96.0 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.969 0.414 . . . . 0.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 37.64 -88.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.435 ' N ' ' O ' ' A' ' 138' ' ' ALA . 4.1 m-20 -79.2 -34.27 43.11 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.789 -176.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.444 ' CD1' ' N ' ' A' ' 141' ' ' PHE . 1.3 m-85 -115.71 178.25 4.37 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 112.23 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 137' ' ' ARG . 9.9 p -113.62 152.19 15.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.598 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -132.06 174.99 9.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.167 0.508 . . . . 0.0 111.561 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.428 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -81.48 166.63 20.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.014 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.713 ' HG ' HG23 ' A' ' 135' ' ' VAL . 3.6 mp -81.19 -33.42 33.01 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.32 -49.31 6.42 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.891 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 65.7 m -51.53 -35.06 38.99 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.201 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.642 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -56.92 117.97 4.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.221 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.34 -176.95 1.69 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.885 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.3 t -100.36 150.08 22.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.957 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 152' ' ' VAL . 8.4 m -69.33 -27.47 34.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.626 HG23 HG23 ' A' ' 151' ' ' VAL . 21.4 t -104.99 -55.69 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.351 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 34.3 m -65.96 -27.92 68.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.979 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 17.9 tttt 58.04 31.94 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.978 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -123.97 144.18 49.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.015 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.525 ' C ' HD22 ' A' ' 157' ' ' LEU . 7.0 mt-30 -61.92 162.41 9.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.322 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.4 mm? -113.99 165.22 12.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.47 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.404 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -145.99 168.75 20.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.489 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.473 HG23 ' C ' ' A' ' 11' ' ' GLY . 5.3 m -43.46 128.42 4.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.67 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 94.63 -25.35 23.56 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.681 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.467 ' C ' HG23 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -66.39 129.69 40.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.784 0.326 . . . . 0.0 110.758 180.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.45 ' HA ' HG23 ' A' ' 9' ' ' VAL . 20.9 mt-10 -87.89 124.17 33.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.005 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.877 ' CD2' HD23 ' A' ' 171' ' ' LEU . 7.1 p90 -140.18 147.72 40.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.012 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.694 ' HB2' HG13 ' A' ' 172' ' ' VAL . 36.8 m-85 -102.16 159.72 15.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.417 HD13 ' HE1' ' A' ' 8' ' ' MET . 1.1 tp -112.86 110.94 21.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.757 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 13.0 mmt -74.63 166.25 23.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.029 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -60.62 -26.96 67.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -96.95 27.93 3.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.073 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 57.46 40.02 27.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.068 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -104.03 141.54 36.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.933 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.877 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -93.3 130.86 38.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.694 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.1 p -145.06 123.68 5.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.073 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 26.4 m -56.51 -170.46 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.95 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -74.4 -57.68 3.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.881 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -58.95 -39.55 82.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.073 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -65.46 -25.7 67.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.957 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.456 ' CD1' ' CG ' ' A' ' 164' ' ' TYR . 9.5 t80 -54.67 -66.13 0.46 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.01 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -67.78 -32.83 73.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.884 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 57.7 m -67.4 -31.56 71.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -80.55 -51.96 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.104 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.35 -67.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . 0.451 ' CB ' ' CE2' ' A' ' 177' ' ' TYR . 1.6 mt-30 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.935 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 60.3 p . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.805 0.336 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 m -80.56 164.98 22.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.895 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.59 31.48 0.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.434 ' O ' HG23 ' A' ' 4' ' ' VAL . 8.4 m -131.21 81.26 66.42 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.161 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.56 -168.02 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.61 2.207 . . . . 0.0 112.269 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -59.73 102.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.92 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.493 HG22 ' N ' ' A' ' 8' ' ' MET . 11.9 p -119.76 158.63 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.606 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -154.49 -178.17 6.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.524 HG23 ' C ' ' A' ' 161' ' ' ASP . 9.8 p -155.05 136.29 5.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.004 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.448 HG21 ' HB3' ' A' ' 157' ' ' LEU . 30.1 t -52.88 146.3 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.903 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.742 ' HA2' HG23 ' A' ' 159' ' ' THR . . . -140.86 -144.14 4.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.534 -0.841 . . . . 0.0 112.817 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 29.8 mt-10 -76.59 120.14 80.4 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.552 0.215 . . . . 0.0 110.808 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.918 ' HB2' HG12 ' A' ' 134' ' ' VAL . 20.7 Cg_exo -62.82 140.08 78.06 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.344 2.029 . . . . 0.0 112.127 179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -159.36 164.55 34.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.746 -179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.802 ' HG ' HG12 ' A' ' 135' ' ' VAL . 0.5 OUTLIER -138.0 173.44 11.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -29.18 68.14 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.809 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 55.14 87.31 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.619 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.33 124.3 1.18 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.569 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -107.08 22.78 15.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.709 0.29 . . . . 0.0 110.865 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 114' ' ' PHE . 0.5 OUTLIER 63.3 -179.9 0.15 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -138.38 133.04 6.07 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.532 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.488 ' HB3' HD22 ' A' ' 27' ' ' LEU . 65.5 m-20 -58.31 -30.53 66.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.836 0.35 . . . . 0.0 110.994 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -59.71 -28.64 67.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.97 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -58.52 -68.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.443 ' HG3' ' CZ ' ' A' ' 102' ' ' PHE . 1.6 mm-40 -95.4 176.08 6.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.867 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.748 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.5 OUTLIER -76.98 144.18 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.84 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.8 tp -112.01 165.14 12.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.931 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.949 HD12 HD21 ' A' ' 88' ' ' LEU . 35.5 mm -62.79 157.54 3.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.034 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.485 ' N ' HG22 ' A' ' 28' ' ' ILE . 3.6 m -124.75 106.95 10.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.924 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.26 101.88 12.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.546 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.578 ' O ' HD12 ' A' ' 31' ' ' LEU . 0.3 OUTLIER -139.71 149.62 43.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.945 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -77.21 145.31 37.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.493 ' O ' HG22 ' A' ' 34' ' ' THR . 2.0 m120 -108.91 -26.51 10.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.031 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.493 HG22 ' O ' ' A' ' 33' ' ' ASN . 15.0 t 45.31 36.0 2.09 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.394 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -113.78 34.69 4.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.825 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.555 ' CZ ' HD13 ' A' ' 42' ' ' ILE . 37.1 t80 -59.58 -69.21 0.22 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -69.85 78.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -115.74 -39.38 3.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.15 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -175.13 107.59 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.127 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m120 62.76 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.025 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.1 -114.98 4.2 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.508 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.641 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.5 mp -84.31 -46.58 17.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.38 162.79 26.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.908 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -142.16 156.8 45.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.911 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -73.17 148.94 43.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -138.03 154.11 22.62 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.549 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -177.99 -61.13 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.53 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -165.63 -74.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.774 0.321 . . . . 0.0 110.826 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -104.99 -67.5 0.71 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.511 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 173.06 -153.82 19.17 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.576 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -105.17 166.48 10.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.869 0.366 . . . . 0.0 110.883 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 97.7 mmm -90.34 120.94 31.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.862 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.76 28.55 73.02 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.452 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 60.38 168.98 0.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.807 0.337 . . . . 0.0 110.942 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -149.94 -175.59 22.27 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.456 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 135.99 -160.75 24.71 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.446 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.0 89.56 2.5 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.644 0.259 . . . . 0.0 110.848 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.35 164.59 30.03 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.459 2.106 . . . . 0.0 112.187 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 58.88 30.63 20.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.749 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.597 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.3 tp -104.76 135.3 19.32 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.067 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.437 ' HD2' HD12 ' A' ' 60' ' ' ILE . 14.8 Cg_endo -58.0 125.93 20.08 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.412 2.075 . . . . 0.0 112.035 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.17 138.67 31.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.091 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 14.5 p -57.43 164.19 2.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.869 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.469 ' HB3' ' CD2' ' A' ' 83' ' ' TRP . . . -84.29 114.61 21.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.377 179.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 122.16 -82.1 0.35 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.482 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.0 p -91.34 154.2 19.38 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 110.94 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -75.8 88.86 2.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.158 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -178.53 135.08 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.597 ' CD2' HG21 ' A' ' 60' ' ' ILE . 11.1 p80 -72.23 145.28 48.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.01 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.461 HD11 ' CD2' ' A' ' 84' ' ' HIS . 5.5 mm -72.27 153.35 7.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.912 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.16 36.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.957 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -112.07 138.14 49.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.815 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -34.06 63.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.192 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -106.55 107.71 18.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.052 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.422 HG22 ' N ' ' A' ' 76' ' ' LEU . 47.9 mm -123.5 153.44 29.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.078 0.466 . . . . 0.0 111.258 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.422 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.0 mp -115.15 106.94 14.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.167 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 46.0 tttt -90.66 123.11 34.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.026 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -154.19 167.04 31.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.066 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.748 HD23 ' HD2' ' A' ' 26' ' ' ARG . 1.7 mt 57.29 34.12 24.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.125 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.84 34.3 14.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.071 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.79 171.98 5.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.058 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -89.72 117.94 28.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.852 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.71 ' NE1' HD12 ' A' ' 79' ' ' LEU . 47.4 m95 -111.44 126.08 54.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.848 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.461 ' CD2' HD11 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -52.53 143.66 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.931 179.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 14.3 p -57.59 -37.58 73.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -91.08 -12.77 34.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.261 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 61.5 m -104.95 22.44 15.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.687 0.28 . . . . 0.0 111.152 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.949 HD21 HD12 ' A' ' 28' ' ' ILE . 18.2 tp -118.88 30.63 7.07 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.859 0.362 . . . . 0.0 110.864 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.6 153.27 20.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.871 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 5.4 t -59.33 147.02 37.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.74 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.77 -28.43 66.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.294 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -105.03 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 0.0 111.253 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.576 ' HB2' HG22 ' A' ' 95' ' ' VAL . 20.2 m -58.82 -29.44 66.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.166 -179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 57.77 21.8 7.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.134 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.576 HG22 ' HB2' ' A' ' 93' ' ' CYS . 5.8 m -90.46 156.61 45.44 Favored Pre-proline 0 N--CA 1.453 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.166 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 118.94 5.77 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.443 2.095 . . . . 0.0 112.245 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.766 HD21 ' HB3' ' A' ' 110' ' ' CYS . 8.3 mp -101.29 72.27 1.42 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -99.5 30.6 3.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.084 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -146.6 -47.44 0.19 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.676 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.3 158.35 44.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.776 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.575 ' HB3' HD11 ' A' ' 28' ' ' ILE . 26.7 p -141.85 175.95 9.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.034 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.48 ' CZ ' ' CE2' ' A' ' 114' ' ' PHE . 1.1 t80 -162.72 152.14 15.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.773 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 10.3 t -134.22 135.04 42.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.402 ' HG3' ' CZ ' ' A' ' 118' ' ' PHE . 28.5 mmt-85 -147.95 124.0 10.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 73.03 -64.31 1.6 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.496 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -166.29 -44.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 110.872 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.05 179.84 1.41 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.929 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 108' ' ' VAL . 12.4 p -108.25 123.0 63.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.008 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -114.42 169.53 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.866 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.766 ' HB3' HD21 ' A' ' 97' ' ' LEU . 21.0 p -121.85 168.21 12.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.634 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 115' ' ' PHE . 8.6 mttp -78.14 -26.75 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HA ' ' CE2' ' A' ' 115' ' ' PHE . 1.7 t70 -54.58 -49.77 69.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.265 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -83.94 -20.53 32.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.267 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.498 ' CE1' ' CE1' ' A' ' 20' ' ' PHE . 9.0 t80 -61.41 -30.5 70.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.977 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.446 ' CE2' ' HA ' ' A' ' 112' ' ' ASP . 5.1 m-85 -69.19 -45.94 68.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.758 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt -85.44 -60.77 1.93 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.594 -179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.27 -52.83 63.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.168 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' A' ' 114' ' ' PHE . 5.0 m-85 -84.29 -43.06 15.19 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -64.3 -136.96 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.514 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 91.5 m -103.06 153.97 19.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.732 0.301 . . . . 0.0 110.789 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.76 162.27 41.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.266 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.3 t -57.47 139.33 53.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.978 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -96.73 29.46 2.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -125.17 -58.15 1.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 15.1 p -107.67 10.37 29.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.358 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.22 36.24 27.12 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.783 0.325 . . . . 0.0 110.973 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 15.3 tp -99.73 137.4 38.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.939 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -64.99 131.74 36.52 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.658 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.7 HG22 HD11 ' A' ' 15' ' ' LEU . 12.0 mt -95.09 128.22 39.74 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 120.395 0.141 . . . . 0.0 110.735 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.628 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 82.4 Cg_exo -42.73 168.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.615 2.21 . . . . 0.0 112.614 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.419 ' O ' ' HA2' ' A' ' 17' ' ' GLY . 23.2 Cg_exo -65.46 -55.36 0.46 Allowed 'Trans proline' 0 CA--C 1.529 0.248 0 C-N-CA 122.75 2.3 . . . . 0.0 113.843 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.859 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -125.52 21.49 7.8 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -178.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.664 HE21 HG23 ' A' ' 129' ' ' ILE . 1.1 pp0? -61.07 136.94 58.23 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.376 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.918 HG12 ' HB2' ' A' ' 13' ' ' PRO . 1.5 t -71.91 108.73 3.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.009 0.433 . . . . 0.0 111.054 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.802 HG12 ' HG ' ' A' ' 15' ' ' LEU . 11.0 p -144.83 159.33 14.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.906 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.489 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.79 136.22 37.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 179.97 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.03 164.31 12.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.033 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.642 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -106.41 96.71 6.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.667 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.438 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 57.92 -86.24 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.361 0.6 . . . . 0.0 111.746 -179.789 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -100.97 -49.18 4.2 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.789 -177.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -84.25 161.26 20.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.597 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG13 ' CD1' ' A' ' 129' ' ' ILE . 7.2 p -103.89 152.21 6.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.553 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -128.54 175.13 8.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.129 0.49 . . . . 0.0 111.654 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 147' ' ' CYS . 0.0 OUTLIER -82.82 163.4 21.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.041 -179.88 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 135' ' ' VAL . 4.1 mp -81.23 -31.71 33.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.734 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -49.28 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.789 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . 0.419 ' H ' ' HB3' ' A' ' 144' ' ' HIS . 78.4 m -52.48 -32.35 39.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.991 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.718 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 0.1 OUTLIER -57.05 119.82 6.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.034 -179.822 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -172.27 -177.04 1.73 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.975 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 26.9 t -101.47 150.09 23.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.03 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 152' ' ' VAL . 24.6 m -68.81 -26.87 33.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.335 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.7 HG23 HG23 ' A' ' 151' ' ' VAL . 27.3 t -107.03 -56.41 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.25 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 36.1 m -65.88 -28.13 68.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.101 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 58.11 34.9 24.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.922 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -126.42 142.34 51.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.969 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.412 ' C ' HD22 ' A' ' 157' ' ' LEU . 6.5 mt-30 -58.38 152.79 16.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.262 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.699 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.3 mm? -109.5 107.96 18.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.455 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . 0.424 ' O ' ' HB ' ' A' ' 10' ' ' VAL . . . -91.3 168.06 11.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.475 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . 0.742 HG23 ' HA2' ' A' ' 11' ' ' GLY . 6.9 m -40.73 132.33 2.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.83 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 95.07 -26.99 16.32 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.618 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.524 ' C ' HG23 ' A' ' 9' ' ' VAL . 3.1 t0 -67.8 128.92 38.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.331 . . . . 0.0 110.84 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.473 ' HA ' HG23 ' A' ' 9' ' ' VAL . 47.3 mt-10 -87.99 114.5 24.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.825 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.805 ' CD2' HD23 ' A' ' 171' ' ' LEU . 11.5 p90 -128.16 143.62 51.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.015 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.517 ' HB2' HG13 ' A' ' 172' ' ' VAL . 11.1 m-85 -100.13 162.43 12.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.748 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.642 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.1 tp -115.04 110.85 20.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.742 179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 11.8 mmt -75.4 164.47 26.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.015 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -59.16 -26.26 64.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.129 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.71 27.09 4.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.099 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 57.0 46.76 18.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.922 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.401 ' CG ' ' CG1' ' A' ' 151' ' ' VAL . 0.1 OUTLIER -110.88 146.54 36.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.805 HD23 ' CD2' ' A' ' 163' ' ' PHE . 4.8 mp -98.31 128.89 44.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.886 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.517 HG13 ' HB2' ' A' ' 164' ' ' TYR . 7.6 p -145.07 130.18 13.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.006 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 55.5 m -53.0 -179.48 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.108 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.413 ' HD2' ' CE2' ' A' ' 164' ' ' TYR . 0.5 OUTLIER -67.95 -61.03 2.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.82 -179.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.32 72.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.95 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -63.58 -26.96 68.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.002 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -55.07 -66.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.007 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -53.99 -26.74 27.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.23 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 6.1 m -78.48 -30.16 47.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.976 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -93.74 -27.25 16.61 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.233 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 7.1 mmmm 63.28 173.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.885 -179.981 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.824 0.345 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -106.79 160.29 15.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.878 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -176.3 -175.97 0.73 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.0 t -106.21 88.04 2.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.105 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 164.25 35.36 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.565 2.177 . . . . 0.0 112.285 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 60.83 87.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.838 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.553 HG23 ' CE1' ' A' ' 164' ' ' TYR . 14.0 p -126.04 158.81 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.1 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.487 ' HE1' ' CE2' ' A' ' 163' ' ' PHE . 0.0 OUTLIER -130.75 -175.09 3.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.636 -179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.401 HG23 ' HA ' ' A' ' 162' ' ' GLU . 4.2 p -154.39 150.8 11.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.156 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 161' ' ' ASP . 38.4 t -67.39 146.25 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.706 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.66 -162.03 10.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.388 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 1.3 mm-40 -71.5 145.37 90.14 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.568 0.223 . . . . 0.0 110.63 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.596 ' HB2' HG12 ' A' ' 134' ' ' VAL . 4.5 Cg_endo -83.02 130.0 5.52 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.655 2.237 . . . . 0.0 112.345 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -150.58 163.73 37.77 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.395 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.564 HD11 ' CG2' ' A' ' 129' ' ' ILE . 0.7 OUTLIER -144.08 173.78 11.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.173 0.511 . . . . 0.0 111.621 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.534 ' HE3' HD22 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -38.27 87.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.428 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.745 ' HA3' HG23 ' A' ' 132' ' ' THR . . . 64.24 81.54 0.11 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.65 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.72 -140.8 5.56 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.248 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 63.5 tt0 179.68 -49.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.405 ' CZ ' ' CE1' ' A' ' 114' ' ' PHE . 0.9 OUTLIER 63.11 144.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.933 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -147.51 -160.45 8.9 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.534 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -83.98 -25.32 30.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.694 0.283 . . . . 0.0 111.096 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -54.09 -26.64 28.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.245 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.43 -75.7 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.059 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 102' ' ' PHE . 18.6 tp10 -101.79 163.5 12.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.867 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.0 ptp85 -75.9 100.01 4.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.867 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.594 HD11 ' HB3' ' A' ' 100' ' ' ARG . 2.1 tp -63.33 165.21 7.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.86 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.808 HD11 ' C ' ' A' ' 99' ' ' GLU . 4.0 pt -62.87 138.58 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.14 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.431 HG22 ' HG ' ' A' ' 31' ' ' LEU . 48.5 m -105.86 106.93 17.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.824 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HE ' HD11 ' A' ' 76' ' ' LEU . 1.1 tpt180 -78.34 101.69 7.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.394 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HG ' HG22 ' A' ' 29' ' ' THR . 0.3 OUTLIER -145.73 164.92 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.007 -179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.451 ' CG ' ' CE1' ' A' ' 74' ' ' PHE . 19.6 mt-10 -90.26 157.02 17.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.954 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -109.73 -29.41 8.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.974 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 34' ' ' THR . 22.5 m 62.18 31.41 17.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.88 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -115.86 71.71 0.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -105.39 31.29 5.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.894 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -158.53 79.78 0.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.927 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -144.53 -47.25 0.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.124 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.528 ' HB3' ' CD2' ' A' ' 71' ' ' LEU . . . -147.02 125.76 12.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.012 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.0 m120 64.25 -78.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 104.2 -89.14 0.65 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.464 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.475 HG22 ' N ' ' A' ' 43' ' ' ASP . 46.9 mm -82.08 158.47 3.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.794 0.33 . . . . 0.0 110.96 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.475 ' N ' HG22 ' A' ' 42' ' ' ILE . 24.4 m-20 -97.3 39.7 1.18 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -143.9 80.16 1.65 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.881 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -91.22 -31.39 16.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.855 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -72.79 131.96 16.75 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.484 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.74 -40.76 2.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.536 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 p -104.92 -178.56 3.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.777 0.322 . . . . 0.0 110.925 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -83.06 -83.85 0.88 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.51 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 99.08 29.89 6.97 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.2 t60 60.47 169.11 0.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.966 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -133.1 163.02 30.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.871 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.63 55.9 2.09 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.51 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.63 -171.28 0.55 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.768 0.318 . . . . 0.0 110.903 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 158.11 -30.99 0.49 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.454 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -169.32 148.21 11.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.534 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.67 86.25 12.55 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 120.733 0.302 . . . . 0.0 110.875 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -51.71 165.82 0.68 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.463 2.109 . . . . 0.0 112.247 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.65 30.8 20.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.81 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.549 HG21 ' CD2' ' A' ' 69' ' ' HIS . 3.1 tp -108.91 134.92 20.2 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.442 ' HD2' HD12 ' A' ' 60' ' ' ILE . 26.2 Cg_endo -63.06 125.92 16.87 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.347 2.031 . . . . 0.0 112.163 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.75 147.36 26.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.053 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.2 t -59.01 154.72 14.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.905 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.501 ' HB1' ' CH2' ' A' ' 83' ' ' TRP . . . -82.86 114.81 21.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.575 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 115.7 -53.37 0.62 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.676 -0.774 . . . . 0.0 112.43 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 19.3 p -103.61 -178.99 3.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.767 0.318 . . . . 0.0 110.876 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.03 76.56 1.01 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.009 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.76 131.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.549 ' CD2' HG21 ' A' ' 60' ' ' ILE . 9.7 p80 -63.97 148.14 50.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.446 HG13 ' CD2' ' A' ' 82' ' ' HIS . 5.7 mm -77.08 153.79 5.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.01 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.528 ' CD2' ' HB3' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -172.64 35.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.832 -179.848 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -104.88 179.11 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.86 -68.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.451 ' CE1' ' CG ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER -80.99 115.96 20.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.441 HG22 ' N ' ' A' ' 76' ' ' LEU . 44.9 mm -123.2 154.93 29.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.301 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.441 ' N ' HG22 ' A' ' 75' ' ' ILE . 8.4 mp -114.59 107.59 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.264 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.2 tttp -90.77 122.44 33.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.063 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.78 ' HB2' ' HA ' ' A' ' 28' ' ' ILE . . . -159.88 158.29 30.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.173 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.63 HD22 ' OG ' ' A' ' 103' ' ' SER . 0.6 OUTLIER 58.19 37.46 26.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.157 179.862 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 61.67 35.71 16.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.074 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -174.39 169.98 3.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.863 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.446 ' CD2' HG13 ' A' ' 70' ' ' ILE . 20.6 p-80 -89.33 125.31 35.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.961 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.658 ' CB ' HD13 ' A' ' 88' ' ' LEU . 58.6 m95 -113.65 125.36 54.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 171.95 0.08 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.063 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 t -80.05 -39.83 28.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.919 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -90.97 -28.26 18.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.988 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 79.1 m -71.96 -28.96 63.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.049 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.685 HD21 HG21 ' A' ' 28' ' ' ILE . 11.2 tp -79.59 82.83 5.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -137.63 150.59 47.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.4 t -64.25 130.06 42.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.789 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -23.49 52.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.491 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -102.13 -63.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.787 0.327 . . . . 0.0 111.226 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.449 ' HB2' HG22 ' A' ' 95' ' ' VAL . 34.0 m -66.54 -33.07 74.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.172 -179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t-160 57.08 22.63 7.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.051 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.499 ' O ' HD13 ' A' ' 97' ' ' LEU . 6.9 m -87.85 152.15 50.81 Favored Pre-proline 0 N--CA 1.453 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.227 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -57.24 118.94 5.9 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.504 2.136 . . . . 0.0 112.169 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.645 ' O ' HD23 ' A' ' 88' ' ' LEU . 8.2 mp -108.86 64.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.746 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -97.97 29.42 3.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.106 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.808 ' C ' HD11 ' A' ' 28' ' ' ILE . 23.0 mm-40 -135.11 -46.51 0.71 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.824 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.594 ' HB3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.05 173.48 11.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.839 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.692 ' CB ' HG23 ' A' ' 28' ' ' ILE . 51.5 t -156.94 156.04 32.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.017 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.472 ' CE1' ' CE2' ' A' ' 114' ' ' PHE . 0.3 OUTLIER -155.96 136.09 12.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.746 179.932 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.63 ' OG ' HD22 ' A' ' 79' ' ' LEU . 2.0 p -151.03 174.12 13.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.009 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -177.2 123.98 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.849 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 83.29 -95.55 1.86 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.535 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -142.19 38.38 1.58 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.361 . . . . 0.0 110.906 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.433 ' HB2' ' CZ ' ' A' ' 109' ' ' TYR . 0.7 OUTLIER -152.65 177.96 10.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.538 ' O ' HG13 ' A' ' 108' ' ' VAL . 11.3 p -149.13 115.99 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.187 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 107' ' ' SER . 0.4 OUTLIER -122.15 159.89 26.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 28.2 p -71.53 160.22 33.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.656 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 115' ' ' PHE . 6.1 ttmt -56.94 -45.12 82.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.074 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.438 ' HA ' ' CD2' ' A' ' 115' ' ' PHE . 30.1 t70 -58.91 -29.5 67.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.107 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -84.1 -26.07 29.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.318 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.472 ' CE2' ' CE1' ' A' ' 102' ' ' PHE . 36.7 t80 -66.8 -39.06 87.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.438 ' CD2' ' HA ' ' A' ' 112' ' ' ASP . 7.5 m-85 -65.38 -39.51 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.881 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 12.1 tttp -84.13 -30.12 26.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.119 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.9 mmm-85 -82.09 -53.79 5.82 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.192 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.25 -42.99 11.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -72.5 167.7 53.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.419 179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 33.0 m -58.5 150.27 23.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.756 0.312 . . . . 0.0 110.914 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 ttpm? -145.49 163.31 35.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.051 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . 0.484 ' HB2' HD11 ' A' ' 129' ' ' ILE . 48.6 t -72.8 130.7 41.05 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.676 ' HB3' ' HB3' ' A' ' 141' ' ' PHE . . . -97.88 28.01 4.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.106 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HB2' ' CE2' ' A' ' 143' ' ' TYR . . . -125.1 -54.62 1.6 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.001 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' CYS . . . . . . . . . . . . . 26.8 p -111.08 -22.61 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.135 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 69.67 69.81 0.24 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.845 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.11 -166.12 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.792 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -103.5 86.95 0.55 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.557 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.752 HG23 HE21 ' A' ' 133' ' ' GLN . 16.3 mt -65.94 126.28 91.53 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.455 0.169 . . . . 0.0 110.833 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.592 ' HB2' ' HB3' ' A' ' 133' ' ' GLN . 51.4 Cg_exo -51.49 -178.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.233 1.955 . . . . 0.0 111.959 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 130' ' ' PRO . 64.9 Cg_endo -77.24 -53.25 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.298 1.998 . . . . 0.0 113.901 -179.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.745 HG23 ' HA3' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -122.94 21.83 9.77 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 0.785 ' OE1' HD11 ' A' ' 145' ' ' LEU . 1.0 OUTLIER -55.49 145.33 23.14 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.365 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.898 ' O ' HD21 ' A' ' 145' ' ' LEU . 0.2 OUTLIER -87.79 108.9 18.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.963 0.411 . . . . 0.0 110.862 -179.838 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.69 HG23 ' HG ' ' A' ' 145' ' ' LEU . 11.4 p -150.5 159.82 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.078 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.507 ' N ' HG22 ' A' ' 135' ' ' VAL . 0.0 OUTLIER -96.71 137.55 35.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.622 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.83 130.67 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.975 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 165' ' ' LEU . . . -70.71 96.65 1.25 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.748 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.449 ' OE1' HD22 ' A' ' 165' ' ' LEU . 0.4 OUTLIER 55.31 -86.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.386 0.612 . . . . 0.0 111.797 -179.773 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.414 ' OD2' ' CZ ' ' A' ' 141' ' ' PHE . 5.5 p-10 -99.6 -47.56 5.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.723 -178.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.676 ' HB3' ' HB3' ' A' ' 123' ' ' ALA . 3.5 m-85 -79.26 163.24 25.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.982 0.42 . . . . 0.0 111.374 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.95 133.05 61.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.739 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' TYR . . . . . 0.628 ' O ' HG21 ' A' ' 135' ' ' VAL . 5.0 m-85 -111.06 171.45 7.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.05 0.452 . . . . 0.0 111.344 -179.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 148' ' ' PHE . 41.1 m80 -99.52 140.01 34.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.844 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.898 HD21 ' O ' ' A' ' 134' ' ' VAL . 0.7 OUTLIER -58.73 -20.07 45.75 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -91.01 -36.49 14.04 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.266 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.47 14.27 32.39 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.871 ' CZ ' HD21 ' A' ' 171' ' ' LEU . 42.5 t80 -104.05 102.31 12.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.71 0.29 . . . . 0.0 110.657 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -156.86 -176.92 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.26 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' CYS . . . . . . . . . . . . . 35.2 t -92.23 150.04 21.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.932 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 152' ' ' VAL . 16.8 m -65.59 -26.7 39.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.315 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.647 HG23 HG23 ' A' ' 151' ' ' VAL . 21.3 t -104.43 -56.28 5.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.345 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' CYS . . . . . . . . . . . . . 20.3 m -65.91 -28.12 68.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.074 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.58 30.0 7.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.13 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 -119.14 153.05 35.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.917 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . 0.424 ' C ' HD22 ' A' ' 157' ' ' LEU . 1.0 OUTLIER -68.24 154.08 42.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.948 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 157' ' ' LEU . 1.0 OUTLIER -115.9 137.46 52.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -109.34 161.28 15.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.039 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 12.7 t -46.23 130.28 10.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.372 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . 109.34 -34.36 5.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.591 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' ' 10' ' ' VAL . 2.2 t0 -65.17 130.29 42.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.722 0.296 . . . . 0.0 110.784 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.401 ' HA ' HG23 ' A' ' 9' ' ' VAL . 48.8 mt-10 -87.96 119.65 28.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.547 ' CD2' HD23 ' A' ' 171' ' ' LEU . 5.7 p90 -134.01 147.57 50.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' TYR . . . . . 0.553 ' CE1' HG23 ' A' ' 7' ' ' VAL . 30.9 m-85 -100.59 147.3 26.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.673 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' LEU . . . . . 0.547 HD11 ' HB1' ' A' ' 138' ' ' ALA . 1.2 tp -105.41 114.19 28.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' MET . . . . . . . . . . . . . 12.5 mmt -69.39 174.49 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.883 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -66.81 -29.08 68.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.028 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -97.74 29.8 3.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.028 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.86 33.95 23.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.949 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.503 ' HG2' HG11 ' A' ' 151' ' ' VAL . 1.4 tpt180 -88.57 132.73 34.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.93 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' LEU . . . . . 0.871 HD21 ' CZ ' ' A' ' 148' ' ' PHE . 0.2 OUTLIER -84.94 121.01 27.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' VAL . . . . . 0.539 HG23 ' HB3' ' A' ' 176' ' ' ASP . 14.6 p -145.02 121.56 4.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.124 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 56.1 m -54.88 -174.37 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.856 0.36 . . . . 0.0 111.084 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 1.2 tttm -69.44 -60.94 2.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.882 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.15 -38.96 84.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.021 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . 0.539 ' HB3' HG23 ' A' ' 172' ' ' VAL . 13.1 m-20 -59.25 -24.77 63.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.94 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -54.77 -63.72 1.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -49.18 -27.9 3.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.304 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 -25.33 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' ALA . . . . . . . . . . . . . . . -92.95 -20.55 20.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.518 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.48 -177.58 0.12 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.836 0.351 . . . . 0.0 110.875 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.88 179.989 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_