data_5utg_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 5utg _Structure_validation_residue.Date_analyzed 2018-01-26 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 ' 6' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--O 1.232 0.159 0 N-CA-C 110.031 -0.359 . . . . 521.04 110.031 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -91.11 116.1 65.74 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.682 -0.236 . . . . 999.99 110.418 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.453 ' HA ' ' OD1' ' A' ' 74' ' ' ASP . 59.9 Cg_endo -72.4 140.2 33.04 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.135 . . . . 546.56 112.783 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -99.68 -12.7 19.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 999.99 111.17 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -107.98 10.79 28.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.087 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.05 124.62 19.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.856 -0.611 . . . . 999.99 111.909 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.5 t-20 -109.98 110.34 21.23 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.311 -0.626 . . . . 280.85 109.311 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.08 -39.34 92.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.294 0.479 . . . . 999.99 112.294 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.501 ' O ' HG11 ' A' ' 17' ' ' VAL . . . -59.83 -41.21 90.83 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.95 0.352 . . . . 200.79 111.95 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -72.56 -27.71 62.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.411 -0.358 . . . . 518.33 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 12' ' ' ASN . 78.2 mm-40 -63.97 -40.04 95.51 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.104 -0.498 . . . . 524.44 112.115 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.501 HG11 ' O ' ' A' ' 14' ' ' ALA . 9.3 p -67.27 -36.07 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 120.757 -0.377 . . . . 407.88 110.938 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.84 -42.61 99.81 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.195 0.521 . . . . 136.03 109.98 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.6 tp -66.08 -42.68 89.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.23 -0.895 . . . . 505.3 110.758 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.16 -41.75 93.45 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.588 -0.733 . . . . 703.51 111.603 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' ' 17' ' ' VAL . 65.7 t -63.15 -43.09 98.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 116.61 -0.268 . . . . 324.41 111.067 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.08 -40.97 97.41 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.884 0.374 . . . . 685.46 110.564 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.58 -43.92 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 115.829 -0.623 . . . . 238.49 111.025 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.3 mt -61.02 -44.16 97.64 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 116.124 -0.489 . . . . 509.15 111.388 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.13 -43.52 95.63 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.58 0.229 . . . . 183.06 111.222 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.78 -39.39 96.59 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 121.146 -0.549 . . . . 63.82 112.435 178.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -72.38 -20.59 61.42 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.6 0.36 . . . . 351.91 111.718 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -78.1 -23.57 47.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.183 -0.207 . . . . 145.09 111.535 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.492 ' O ' HG13 ' A' ' 32' ' ' VAL . 95.6 mtt-85 -65.48 -42.48 92.17 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.089 0.471 . . . . 999.99 110.026 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -25.14 73.58 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.722 -0.672 . . . . 82.9 112.636 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.0 tp -63.09 -44.68 95.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.592 0.234 . . . . 392.81 111.248 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 29' ' ' ARG . 10.0 p -66.41 -31.73 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.462 -0.335 . . . . 455.7 111.137 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.51 -40.58 95.9 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.971 0.415 . . . . 756.66 110.258 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.3 t90 -67.07 -38.94 86.66 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.706 -0.679 . . . . 999.99 109.292 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.37 -36.34 79.97 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.029 -0.987 . . . . 373.99 111.298 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -65.5 -21.27 66.61 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.058 0.392 . . . . 811.35 112.058 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 63.6 t -86.43 -47.59 16.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 112.521 0.563 . . . . 461.27 112.521 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.14 17.23 21.84 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.279 0.474 . . . . 575.93 112.279 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.81 -39.29 96.6 Favored Glycine 0 CA--C 1.518 0.239 0 N-CA-C 114.446 0.538 . . . . 226.53 114.446 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -63.27 -26.32 68.72 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.492 0.553 . . . . 999.99 112.492 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 p -113.15 8.11 18.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.96 0.356 . . . . 432.8 111.96 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.4 tp -72.39 121.98 20.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.805 0.336 . . . . 844.62 111.535 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.6 p -80.78 169.24 17.84 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.385 -0.371 . . . . 316.62 110.258 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.3 m -62.38 -43.96 97.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.741 0.305 . . . . 291.13 111.209 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -28.42 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 467.63 112.539 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 15.0 mm100 -62.71 -39.45 94.08 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.42 0.155 . . . . 430.34 111.42 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -60.57 -46.84 88.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.86 0.362 . . . . 667.57 110.202 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.91 -38.6 86.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.872 -0.604 . . . . 527.8 110.794 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.01 81.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.662 -0.699 . . . . 169.13 111.496 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.4 mt -60.88 -36.41 79.12 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.158 -0.474 . . . . 409.47 111.796 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -61.07 -39.49 90.1 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.372 -0.603 . . . . 686.82 109.372 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -65.97 -40.94 91.71 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.619 -0.719 . . . . 213.85 109.603 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.57 -41.97 92.28 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 115.729 -0.669 . . . . 289.44 110.448 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -59.49 -41.65 90.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.927 -0.579 . . . . 358.19 110.821 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.2 -41.95 96.84 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.068 -0.253 . . . . 999.99 110.619 178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -64.79 -40.23 94.9 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.29 0.567 . . . . 999.99 109.982 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -60.42 -46.62 89.37 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.083 -0.962 . . . . 212.58 110.234 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ttt -59.11 -43.65 91.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.772 -0.649 . . . . 262.65 110.795 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -62.72 -42.61 99.74 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.799 0.333 . . . . 684.75 110.993 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.1 m -68.32 -42.89 78.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.22 0.533 . . . . 450.86 110.861 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.421 ' NE2' ' HE1' ' A' ' 65' ' ' TYR . 71.7 t60 -63.27 -38.74 92.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.512 -0.767 . . . . 587.54 110.759 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -55.95 -32.66 64.04 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.893 -0.594 . . . . 785.5 112.553 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.74 -38.68 78.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 290.18 111.681 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -43.46 97.45 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.897 0.379 . . . . 676.15 111.73 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.421 ' HE1' ' NE2' ' A' ' 61' ' ' HIS . 76.8 m-85 -84.74 -20.45 31.07 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.706 0.632 . . . . 824.3 112.706 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.7 ttt -50.92 -50.19 58.16 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.568 0.581 . . . . 839.61 112.568 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 87.3 mt -64.6 -41.9 95.92 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 111.9 0.333 . . . . 667.86 111.9 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -71.26 -52.76 17.15 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.398 0.888 . . . . 999.99 113.398 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.1 mt -84.85 -60.09 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 114.752 1.39 . . . . 648.32 114.752 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.23 -42.19 99.21 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.373 1.249 . . . . 555.82 114.373 -175.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 40.2 ttpt -62.22 -45.91 91.24 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.739 -0.384 . . . . 912.86 111.297 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -65.13 -42.43 93.86 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.92 0.341 . . . . 999.99 111.92 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.2 mt -62.88 -46.78 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.628 0.251 . . . . 322.08 111.203 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.453 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 36.6 t70 -63.0 -45.6 91.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.355 -0.384 . . . . 443.19 111.468 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.01 -40.63 96.78 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.069 0.396 . . . . 427.97 112.069 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.14 -39.18 79.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.319 . . . . 552.67 111.522 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.03 -3.47 84.55 Favored Glycine 0 CA--C 1.518 0.27 0 C-N-CA 120.844 -0.693 . . . . 282.78 112.311 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -74.15 149.87 40.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.826 0.346 . . . . 999.99 111.036 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.0 p -112.63 95.31 32.03 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.338 -0.392 . . . . 423.41 111.059 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.86 146.08 98.06 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.061 2.507 . . . . 262.13 112.463 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.92 -179.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 322.52 111.232 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.69 -42.33 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.28 -0.418 . . . . 195.73 111.157 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.557 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.58 -40.45 97.87 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.682 -0.771 . . . . 116.64 112.143 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.81 -40.95 96.05 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.902 0.382 . . . . 397.23 110.718 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -68.55 -37.69 80.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.868 -0.605 . . . . 273.3 112.278 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -61.48 -35.15 76.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.917 -0.313 . . . . 391.43 111.077 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.2 mmm180 -66.75 -40.65 88.39 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.171 0.51 . . . . 999.99 110.092 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.46 -38.89 88.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.499 -0.773 . . . . 292.18 110.585 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.65 -39.04 96.01 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.536 -0.756 . . . . 65.97 112.615 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.07 96.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.617 0.246 . . . . 184.99 110.802 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -66.25 -41.67 89.66 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.98 0.419 . . . . 381.14 110.335 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.01 -43.41 97.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.931 -0.577 . . . . 354.06 110.796 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -79.08 -2.05 86.42 Favored Glycine 0 CA--C 1.519 0.342 0 CA-C-N 116.022 -0.535 . . . . 88.8 113.43 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -77.38 -31.34 54.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 999.99 110.709 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -103.48 112.55 25.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 999.99 110.152 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.5 mt -128.18 124.01 61.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.367 -0.379 . . . . 458.46 110.059 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -140.46 70.96 1.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.887 0.375 . . . . 388.05 111.097 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 61.8 mtt -70.31 -28.17 64.96 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.969 -0.559 . . . . 538.07 111.19 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.24 82.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.918 -0.583 . . . . 282.7 111.285 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -59.52 -47.82 84.03 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.241 -0.436 . . . . 999.99 110.83 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -60.29 -47.76 84.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.345 -0.389 . . . . 504.74 110.304 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -59.83 -47.87 83.96 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.765 -0.652 . . . . 999.99 111.154 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -60.84 -46.7 89.53 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.41 -0.359 . . . . 558.87 111.255 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.83 98.69 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.459 -0.337 . . . . 412.73 111.388 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.25 -44.27 92.29 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.077 -0.51 . . . . 665.66 110.783 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -63.68 -41.91 98.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.673 -0.694 . . . . 999.99 110.952 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.83 -42.83 85.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.09 -0.504 . . . . 746.24 112.171 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -88.43 -7.9 55.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.173 -0.211 . . . . 999.99 111.493 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.04 39.04 31.43 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.081 0.771 . . . . 848.93 113.081 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.15 61.26 1.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.882 0.373 . . . . 999.99 110.743 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.0 mt -82.13 121.7 79.01 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.222 -0.445 . . . . 586.78 110.699 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.94 152.73 63.44 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.563 2.176 . . . . 310.73 112.548 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -74.79 136.3 41.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 866.09 110.767 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -69.58 90.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 999.99 110.963 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.16 145.36 29.87 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.009 -0.541 . . . . 579.24 111.564 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.06 -30.28 47.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.555 2.17 . . . . 684.25 112.35 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -63.29 -45.48 91.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.102 -0.499 . . . . 662.15 110.185 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 98.1 mtp -62.36 -40.24 95.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.927 -0.579 . . . . 999.99 110.164 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.26 -41.6 97.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.535 -0.757 . . . . 675.31 110.535 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.22 -39.42 93.93 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.838 -0.619 . . . . 900.95 110.883 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 90.0 mt -61.51 -44.0 97.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 116.086 -0.506 . . . . 500.83 110.872 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.08 -36.38 83.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 834.99 111.147 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -70.54 -16.12 62.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 999.99 112.229 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 75.1 mtm -69.93 140.07 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.973 -0.291 . . . . 599.62 110.811 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.473 ' O ' HG22 ' A' ' 129' ' ' VAL . 59.6 ttp180 -51.41 129.82 33.57 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.857 -0.611 . . . . 999.99 111.367 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -53.15 -34.74 70.18 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.383 2.722 . . . . 214.74 113.326 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.51 76.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 248.66 111.838 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -91.11 0.48 57.53 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.946 0.35 . . . . 360.37 111.946 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 125' ' ' ARG . 58.4 t -98.19 111.11 58.72 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.715 0.293 . . . . 334.76 111.138 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.39 151.03 82.24 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.084 2.523 . . . . 351.83 112.301 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.98 142.72 32.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.984 0.421 . . . . 410.42 110.704 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -132.78 148.14 52.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.91 -0.586 . . . . 999.99 110.557 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -83.99 173.92 10.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 551.94 110.349 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.237 -0.887 . . . . 965.93 110.921 -178.94 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.437 -0.209 . . . . 521.04 110.437 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.76 129.25 65.9 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.599 -0.273 . . . . 999.99 110.311 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.73 130.03 15.28 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.315 2.01 . . . . 546.56 113.258 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -124.84 1.69 8.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 999.99 110.918 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -104.73 8.93 35.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.376 . . . . 999.99 111.81 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.3 mt -56.78 113.7 1.76 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.893 0.378 . . . . 999.99 111.767 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -114.37 115.01 26.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.722 -0.473 . . . . 280.85 109.722 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -61.7 -39.76 92.59 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.474 -0.33 . . . . 999.99 111.74 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -40.41 89.34 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.968 0.413 . . . . 200.79 111.644 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -71.35 -31.39 67.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.095 -0.502 . . . . 518.33 110.492 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -65.14 -41.19 95.03 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.824 -0.626 . . . . 524.44 112.016 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.437 ' CG1' ' HA ' ' A' ' 127' ' ' ALA . 18.7 m -73.99 -29.83 26.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.731 -0.388 . . . . 407.88 111.455 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.92 -40.04 95.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.561 0.696 . . . . 136.03 109.262 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.455 ' O ' HG12 ' A' ' 23' ' ' ILE . 61.2 tp -64.64 -39.64 94.06 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.712 -1.131 . . . . 505.3 111.082 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.479 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 98.2 mttt -59.58 -40.5 87.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.191 -0.459 . . . . 703.51 111.155 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 24' ' ' ILE . 77.6 t -65.42 -44.32 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.879 0.371 . . . . 324.41 111.199 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -66.12 -42.23 89.47 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.775 0.657 . . . . 685.46 112.775 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 19' ' ' LEU . 44.0 pt -81.42 -27.64 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 113.394 0.887 . . . . 238.49 113.394 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.53 HG23 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -58.43 -35.73 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.534 0.207 . . . . 509.15 111.513 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.66 92.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 183.06 111.237 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.57 -41.74 89.47 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.158 -0.544 . . . . 63.82 112.828 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.407 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 37.8 m-85 -71.17 -24.97 62.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.635 0.235 . . . . 351.91 111.635 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.454 ' O ' HG22 ' A' ' 32' ' ' VAL . 34.7 t70 -75.45 -38.84 59.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.719 -0.219 . . . . 145.09 110.899 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.58 -41.28 98.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.924 0.392 . . . . 999.99 110.01 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.81 -39.97 96.99 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.732 -0.667 . . . . 82.9 112.275 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 27' ' ' PHE . 86.4 mt -64.59 -38.81 92.3 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.466 0.173 . . . . 392.81 111.466 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.454 HG22 ' O ' ' A' ' 28' ' ' ASP . 60.6 t -60.25 -46.0 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.67 -0.241 . . . . 455.7 110.878 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -63.59 -40.59 97.33 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.052 0.454 . . . . 756.66 110.389 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -64.49 -42.24 95.97 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.695 -0.684 . . . . 999.99 110.279 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.98 -36.94 82.99 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.816 -0.629 . . . . 373.99 111.296 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -61.6 -37.61 84.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.708 0.29 . . . . 811.35 111.275 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.4 t -87.35 -50.51 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 113.378 0.881 . . . . 461.27 113.378 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.567 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.13 -29.46 8.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.251 0.834 . . . . 575.93 113.251 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.7 -35.09 84.93 Favored Glycine 0 N--CA 1.462 0.37 0 CA-C-N 116.588 -0.278 . . . . 226.53 113.793 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -58.2 -39.49 79.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.961 0.356 . . . . 999.99 111.961 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.9 p -87.3 -10.15 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.749 0.648 . . . . 432.8 112.749 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 98.0 mt -73.39 150.98 41.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.134 0.492 . . . . 844.62 111.963 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.4 m -77.08 162.79 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.673 . . . . 316.62 110.565 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.5 m -59.9 -41.13 90.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.216 -0.447 . . . . 291.13 111.187 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 77.8 t -65.64 -41.71 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.27 -0.423 . . . . 467.63 110.642 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.94 -39.84 95.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.085 -0.507 . . . . 430.34 110.913 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -61.83 -44.25 97.22 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.238 -0.437 . . . . 667.57 110.789 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -39.31 93.84 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.277 -0.42 . . . . 527.8 110.92 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -23.89 66.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.777 -0.647 . . . . 169.13 112.149 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.2 -37.36 82.7 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.285 0.476 . . . . 409.47 112.285 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -59.01 -46.94 86.93 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.157 -0.683 . . . . 686.82 109.157 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -62.21 -44.23 97.04 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.422 -0.808 . . . . 213.85 110.421 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.4 t -61.15 -42.46 93.38 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 CA-C-N 116.451 -0.341 . . . . 289.44 110.492 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.45 -40.33 90.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.229 -0.441 . . . . 358.19 111.051 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -61.15 -46.96 88.38 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.001 -0.37 . . . . 999.99 110.001 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -64.73 -39.37 93.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.375 0.607 . . . . 999.99 110.21 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' A' ' 96' ' ' ILE . 90.9 t80 -58.36 -47.75 82.81 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.121 -0.945 . . . . 212.58 110.586 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.0 ttt -60.48 -45.24 94.48 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 262.65 110.816 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -62.32 -39.26 92.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 684.75 111.653 -179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.9 m -60.51 -48.24 82.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.397 -0.365 . . . . 450.86 110.976 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.48 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 82.7 m-70 -70.22 -39.13 75.29 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.425 -0.352 . . . . 587.54 111.204 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -61.4 -45.43 94.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.966 -0.561 . . . . 785.5 111.452 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.28 87.56 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 111.729 0.27 . . . . 290.18 111.729 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -62.78 -46.08 89.66 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.928 0.394 . . . . 676.15 111.129 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.48 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 48.9 m-85 -70.68 -33.82 71.32 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.137 -0.483 . . . . 824.3 111.761 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 1.8 mmt -49.09 -41.33 35.31 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.909 0.707 . . . . 839.61 112.909 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.4 mt -61.96 -43.91 97.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.718 0.294 . . . . 667.86 111.111 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -70.17 -43.93 69.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 999.99 111.051 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.454 ' O ' HG12 ' A' ' 73' ' ' ILE . 97.2 mt -63.65 -47.92 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 115.619 -0.719 . . . . 648.32 111.922 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -62.55 -40.64 97.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.317 -0.401 . . . . 555.82 111.685 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.7 -46.8 89.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.671 -0.24 . . . . 912.86 110.918 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -65.85 -41.79 91.28 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.555 -0.293 . . . . 999.99 111.529 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.9 mm -65.16 -46.38 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.491 -0.322 . . . . 322.08 111.04 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -62.99 -43.61 98.31 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.269 -0.423 . . . . 443.19 111.783 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.26 97.0 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.459 -0.337 . . . . 427.97 111.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.66 -42.62 50.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.028 0.442 . . . . 552.67 111.012 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.89 -14.69 64.56 Favored Glycine 0 CA--C 1.518 0.234 0 CA-C-N 115.845 -0.616 . . . . 282.78 112.431 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -75.57 139.06 41.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.596 0.236 . . . . 999.99 110.85 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 68.7 p -75.36 139.4 71.7 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.747 -0.206 . . . . 423.41 110.653 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.47 142.56 33.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.423 2.082 . . . . 262.13 112.924 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.421 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 18.6 m -102.87 171.42 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.503 . . . . 322.52 111.095 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 76.8 t -60.78 -42.52 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.305 -0.407 . . . . 195.73 110.52 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.31 96.02 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.957 -0.64 . . . . 116.64 112.234 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.826 0.346 . . . . 397.23 110.178 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.421 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 28.2 m-85 -62.96 -41.78 99.63 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.935 -0.575 . . . . 273.3 111.226 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 77.2 p -68.03 -36.37 79.82 Favored 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 111.847 0.314 . . . . 391.43 111.847 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.9 -41.66 95.41 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.032 0.444 . . . . 999.99 110.15 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -69.37 -39.02 78.29 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.629 -0.714 . . . . 292.18 110.205 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -36.73 93.41 Favored Glycine 0 C--N 1.333 0.365 0 CA-C-N 115.176 -0.92 . . . . 65.97 113.175 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.9 85.08 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.427 0.156 . . . . 184.99 111.209 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.97 -40.66 96.35 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.969 0.414 . . . . 381.14 110.252 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -64.53 -43.58 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.828 -0.624 . . . . 354.06 110.545 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.401 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . -64.44 -22.45 67.62 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.719 -0.673 . . . . 88.8 113.95 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.2 -14.2 58.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.034 0.417 . . . . 999.99 111.489 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.75 115.38 29.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.632 0.253 . . . . 999.99 110.866 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.492 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 43.4 pt -129.78 147.44 33.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.996 0.427 . . . . 458.46 111.241 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -148.08 34.98 0.82 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.0 -0.546 . . . . 388.05 110.976 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.9 mmm -61.95 -39.5 92.32 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.189 -0.46 . . . . 538.07 111.382 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.7 88.98 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.174 -0.466 . . . . 282.7 111.104 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -68.94 -30.94 69.49 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.756 -0.656 . . . . 999.99 111.666 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.451 ' O ' HD21 ' A' ' 105' ' ' LEU . 88.8 t80 -58.78 -49.65 76.88 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.751 0.31 . . . . 504.74 110.833 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -66.87 -37.14 83.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.462 -0.335 . . . . 999.99 111.309 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.97 -44.46 97.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.415 -0.357 . . . . 558.87 110.385 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.18 -41.65 99.24 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.029 -0.532 . . . . 412.73 111.114 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.451 HD21 ' O ' ' A' ' 101' ' ' PHE . 3.8 mm? -66.05 -41.49 90.74 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.07 -0.514 . . . . 665.66 110.754 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -62.55 -41.12 98.69 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.119 -0.491 . . . . 999.99 110.65 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.56 -40.2 78.36 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.975 -0.557 . . . . 746.24 111.314 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.2 -4.42 59.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.313 -0.403 . . . . 999.99 111.04 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 57.64 39.85 27.15 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.851 -0.613 . . . . 848.93 111.428 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 98.7 mmm -108.36 114.25 27.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.424 -0.353 . . . . 999.99 111.321 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.1 mt -94.44 118.99 66.96 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 586.78 109.831 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.72 126.72 12.31 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.019 1.812 . . . . 310.73 113.053 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -87.11 156.41 19.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.768 -0.651 . . . . 866.09 110.774 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.423 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 75.4 t80 -67.27 125.92 27.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.025 -0.361 . . . . 999.99 110.025 178.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.3 mt -98.62 138.08 20.71 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.535 -0.302 . . . . 579.24 111.363 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.84 -23.17 55.48 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.655 2.237 . . . . 684.25 111.861 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -63.84 -30.17 71.29 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.559 -0.746 . . . . 662.15 110.822 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.6 mtt -60.13 -39.16 85.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.962 -0.563 . . . . 999.99 110.66 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -61.09 -40.87 95.35 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.215 -0.448 . . . . 675.31 110.69 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.27 -41.11 97.07 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.137 -0.483 . . . . 900.95 111.069 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.98 -44.53 99.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.351 -0.386 . . . . 500.83 110.816 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.54 -39.63 94.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.392 -0.367 . . . . 834.99 111.632 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -68.01 -33.43 74.6 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.206 0.447 . . . . 999.99 112.206 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -83.33 130.45 35.06 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.08 0.4 . . . . 599.62 112.08 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -53.6 145.66 28.41 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 115.731 -0.668 . . . . 999.99 111.117 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -27.47 84.92 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.609 2.206 . . . . 214.74 112.618 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.437 ' HA ' ' CG1' ' A' ' 17' ' ' VAL . . . -71.07 -19.75 62.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 248.66 111.29 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -103.5 12.69 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.334 -0.394 . . . . 360.37 111.194 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.4 t -98.82 110.43 57.33 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.834 0.35 . . . . 334.76 110.696 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.94 166.59 26.58 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.091 2.527 . . . . 351.83 112.957 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.37 136.33 42.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.047 -0.723 . . . . 410.42 109.047 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -115.67 131.11 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.875 0.369 . . . . 999.99 110.191 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -76.53 158.58 31.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.304 0.573 . . . . 551.94 112.21 -178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 74.3 mmm . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.264 -0.874 . . . . 965.93 111.526 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.086 0.47 . . . . 521.04 110.456 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -89.82 119.61 69.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.948 -0.569 . . . . 999.99 110.217 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.99 137.76 82.54 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.537 2.158 . . . . 546.56 112.386 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -106.81 -67.1 0.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 999.99 111.601 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -105.43 4.27 30.5 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.024 0.379 . . . . 999.99 112.024 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.64 125.25 22.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.58 -0.282 . . . . 999.99 110.957 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -99.53 112.02 24.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.339 . . . . 280.85 110.632 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -61.89 -39.67 92.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.795 -0.639 . . . . 999.99 111.354 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.81 80.03 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.367 -0.379 . . . . 200.79 111.983 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -64.09 -36.06 82.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.414 -0.357 . . . . 518.33 110.123 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 79.2 mm-40 -64.87 -40.39 95.04 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.921 -0.581 . . . . 524.44 110.078 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.4 -47.65 92.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 115.654 -0.703 . . . . 407.88 111.631 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -40.67 97.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 136.03 111.049 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.57 -41.74 92.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.903 -0.59 . . . . 505.3 111.615 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.465 ' O ' HG12 ' A' ' 24' ' ' ILE . 57.1 mtmt -60.24 -38.64 84.06 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.589 -0.278 . . . . 703.51 111.488 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.4 t -63.39 -43.68 98.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.635 0.255 . . . . 324.41 110.349 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -65.7 -40.39 92.23 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.365 -0.38 . . . . 685.46 110.708 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.58 HG23 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -64.85 -42.41 94.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.94 -0.573 . . . . 238.49 110.915 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.586 HD13 ' SD ' ' A' ' 58' ' ' MET . 26.9 mm -60.07 -42.79 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.069 -0.514 . . . . 509.15 111.328 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.29 -42.97 96.6 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 111.559 0.207 . . . . 183.06 111.559 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.98 -44.3 96.15 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.744 -0.741 . . . . 63.82 112.848 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -73.03 -20.41 61.0 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.77 0.285 . . . . 351.91 111.77 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -75.63 -39.54 57.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.041 -0.355 . . . . 145.09 110.041 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.523 ' O ' HG21 ' A' ' 32' ' ' VAL . 27.5 mmm180 -63.95 -42.0 97.43 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.328 -0.619 . . . . 999.99 109.328 177.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.477 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -64.53 -39.78 97.1 Favored Glycine 0 CA--C 1.52 0.374 0 CA-C-N 115.551 -0.749 . . . . 82.9 112.282 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.419 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 66.5 tp -59.19 -46.3 88.78 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.181 0.437 . . . . 392.81 112.181 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.523 HG21 ' O ' ' A' ' 29' ' ' ARG . 35.3 m -67.57 -27.08 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 120.835 -0.346 . . . . 455.7 111.883 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.4 ' O ' HG21 ' A' ' 37' ' ' VAL . 98.2 mttt -63.86 -40.71 97.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.826 0.346 . . . . 756.66 110.937 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.477 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 2.7 m-90 -78.4 -31.77 48.44 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.773 0.321 . . . . 999.99 111.184 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 91.7 mt -63.02 -39.81 95.88 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.2 -0.454 . . . . 373.99 111.681 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -71.04 -19.31 62.51 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.886 0.328 . . . . 811.35 111.886 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 33' ' ' LYS . 72.3 t -85.84 -44.88 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.734 0.302 . . . . 461.27 111.767 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -100.46 9.62 42.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.758 0.313 . . . . 575.93 111.547 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.25 -19.63 70.53 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.127 -0.488 . . . . 226.53 114.199 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -64.15 -34.42 78.02 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.177 0.488 . . . . 999.99 112.226 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 58.5 p -114.05 -0.13 14.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.855 0.359 . . . . 432.8 111.79 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -72.31 124.95 26.17 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 844.62 111.836 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.9 m -77.82 158.91 29.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 316.62 110.705 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -60.67 -43.35 97.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.871 0.367 . . . . 291.13 111.203 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.3 t -66.62 -41.65 88.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.096 -0.502 . . . . 467.63 110.824 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.424 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 97.1 mt-30 -62.95 -39.54 94.96 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.967 -0.56 . . . . 430.34 111.511 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.05 -47.32 86.37 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.627 0.251 . . . . 667.57 111.105 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -65.21 -39.55 92.94 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.848 0.356 . . . . 527.8 110.858 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.92 86.55 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.838 -0.619 . . . . 169.13 111.363 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.0 mt -61.31 -36.42 80.06 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.042 -0.527 . . . . 409.47 112.244 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -59.54 -41.17 89.45 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.676 -0.49 . . . . 686.82 109.676 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -67.26 -41.44 85.54 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.864 -0.607 . . . . 213.85 110.039 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.79 -42.94 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.97 -0.559 . . . . 289.44 110.502 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -60.07 -42.78 95.29 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.078 -0.51 . . . . 358.19 110.539 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -63.32 -42.67 99.0 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.328 -0.396 . . . . 999.99 110.567 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -63.95 -43.08 96.88 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.138 0.494 . . . . 999.99 110.242 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -60.32 -47.35 86.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.335 -0.848 . . . . 212.58 110.51 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.586 ' SD ' HD13 ' A' ' 24' ' ' ILE . 1.2 ttp -60.0 -44.16 94.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.666 -0.697 . . . . 262.65 110.851 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.62 -41.51 99.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.113 -0.494 . . . . 684.75 110.976 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.0 m -62.5 -47.06 85.6 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.287 -0.415 . . . . 450.86 111.231 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -64.37 -47.07 80.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.041 -0.527 . . . . 587.54 110.75 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -62.82 -47.73 82.14 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.345 0.498 . . . . 785.5 112.345 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.79 78.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.784 0.661 . . . . 290.18 112.784 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.99 -50.36 74.38 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 121.223 -0.191 . . . . 676.15 111.341 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -73.02 -41.06 64.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.731 0.3 . . . . 824.3 111.209 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.4 tmm? -54.71 -47.32 73.87 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.709 -0.678 . . . . 839.61 112.327 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.3 mt -61.35 -41.09 96.49 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 111.928 0.344 . . . . 667.86 111.928 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -62.51 -47.9 81.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 999.99 111.494 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.6 tt -78.47 -32.19 16.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.621 0.6 . . . . 648.32 112.621 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -60.95 -41.5 96.42 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.63 0.252 . . . . 555.82 111.225 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -60.68 -45.98 92.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 912.86 110.254 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.17 -43.03 93.02 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.907 -0.588 . . . . 999.99 111.474 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.34 -46.36 95.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-O 120.785 0.326 . . . . 322.08 111.394 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.45 -45.1 94.62 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.168 -0.469 . . . . 443.19 111.27 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.3 95.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.438 -0.346 . . . . 427.97 111.81 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.48 -38.48 81.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.557 -0.292 . . . . 552.67 111.502 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.22 6.92 70.64 Favored Glycine 0 CA--C 1.518 0.259 0 C-N-CA 120.772 -0.728 . . . . 282.78 112.465 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -74.04 151.23 40.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.846 0.355 . . . . 999.99 110.981 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.7 p -114.91 95.08 40.4 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 423.41 111.238 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -72.31 155.79 55.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.731 2.287 . . . . 262.13 112.66 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.5 m -100.3 175.49 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 322.52 111.445 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.0 t -60.19 -40.88 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.147 -0.479 . . . . 195.73 111.193 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.4 -39.69 95.13 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.842 -0.694 . . . . 116.64 112.475 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.31 -40.18 95.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.022 0.439 . . . . 397.23 110.347 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -68.47 -39.19 81.48 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.68 -0.691 . . . . 273.3 111.838 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.9 p -66.42 -29.66 69.85 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.835 0.309 . . . . 391.43 111.835 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -63.57 -42.14 98.35 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.01 0.433 . . . . 999.99 110.056 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.26 -41.0 74.05 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.812 -0.631 . . . . 292.18 110.493 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.09 -40.4 99.17 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.417 -0.811 . . . . 65.97 112.95 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.57 -41.97 98.16 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.432 0.158 . . . . 184.99 111.301 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.93 -41.86 97.51 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.936 0.398 . . . . 381.14 110.55 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 92.8 mt -65.27 -42.9 95.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.768 -0.651 . . . . 354.06 110.912 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.32 -20.92 65.88 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 116.019 -0.537 . . . . 88.8 113.544 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 95.7 mtt-85 -79.44 -17.54 54.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.916 0.358 . . . . 999.99 111.42 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -108.71 110.93 22.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.885 0.374 . . . . 999.99 110.88 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.8 mt -129.39 125.55 62.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.831 -0.433 . . . . 458.46 109.831 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -122.46 51.56 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.976 0.417 . . . . 388.05 110.999 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.4 ptm -91.96 -9.73 41.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.123 -0.49 . . . . 538.07 111.837 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.47 95.91 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.837 0.351 . . . . 282.7 111.753 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -70.06 -28.24 65.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.465 . . . . 999.99 111.247 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -58.2 -46.57 85.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.339 -0.391 . . . . 504.74 111.217 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.608 0.242 . . . . 999.99 111.11 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.5 -45.3 69.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.349 -0.387 . . . . 558.87 110.908 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.17 96.07 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.98 -0.554 . . . . 412.73 111.816 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.38 -47.89 84.13 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.421 -0.354 . . . . 665.66 110.83 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -64.27 -40.25 95.61 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.272 -0.422 . . . . 999.99 111.102 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.09 -39.05 80.99 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.001 -0.545 . . . . 746.24 112.16 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -83.0 -11.94 57.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 111.66 0.244 . . . . 999.99 111.66 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.8 t30 52.56 48.64 22.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.027 0.441 . . . . 848.93 111.391 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 19.2 mmt -122.98 102.67 8.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.369 -0.378 . . . . 999.99 110.84 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.2 mt -93.93 117.57 67.21 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.492 -0.322 . . . . 586.78 110.326 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.36 149.48 50.78 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.439 2.093 . . . . 310.73 112.846 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -84.59 147.16 27.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 866.09 110.227 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -66.77 123.04 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 999.99 110.689 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 85.6 mt -98.89 120.73 57.97 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.083 -0.508 . . . . 579.24 111.447 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.67 -28.45 81.62 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.025 2.484 . . . . 684.25 112.37 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.49 -29.0 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.704 -0.68 . . . . 662.15 111.709 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 66.6 mtt -60.01 -39.21 85.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.568 -0.287 . . . . 999.99 110.758 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.41 -40.72 95.42 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.176 -0.465 . . . . 675.31 110.936 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -62.12 -44.38 96.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.174 -0.466 . . . . 900.95 110.966 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.51 -45.09 99.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.353 -0.385 . . . . 500.83 111.11 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -63.09 -40.89 98.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.251 -0.431 . . . . 834.99 112.007 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -66.35 -33.71 76.33 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.383 0.512 . . . . 999.99 112.383 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.8 mtm -80.25 136.98 36.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.789 0.328 . . . . 599.62 111.665 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.487 ' O ' HG22 ' A' ' 129' ' ' VAL . 77.3 mtp85 -53.4 144.12 32.9 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 115.815 -0.63 . . . . 999.99 111.165 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -52.89 -33.95 63.89 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.233 2.622 . . . . 214.74 113.061 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.79 -36.37 78.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 248.66 111.809 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.45 -0.51 57.63 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.972 0.36 . . . . 360.37 111.972 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 125' ' ' ARG . 62.9 t -91.7 114.61 62.48 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.705 0.288 . . . . 334.76 111.022 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.04 157.9 50.3 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.653 2.235 . . . . 351.83 112.352 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 m -120.61 155.89 23.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.299 -0.41 . . . . 410.42 110.761 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -98.26 119.59 37.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.025 0.441 . . . . 999.99 111.381 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -84.37 155.69 22.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.767 -0.651 . . . . 551.94 109.911 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.261 -0.876 . . . . 965.93 111.051 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.2 t . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.903 0.382 . . . . 521.04 110.413 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.99 156.07 72.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.424 . . . . 999.99 110.986 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.32 151.37 65.84 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.464 2.109 . . . . 546.56 112.323 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.5 ' HG3' ' CD1' ' A' ' 10' ' ' PHE . 22.5 tptm -104.0 123.57 47.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 999.99 110.305 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.5 ' CD1' ' HG3' ' A' ' 9' ' ' LYS . 75.3 m-85 59.01 39.4 23.53 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.575 0.547 . . . . 999.99 111.683 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -56.99 120.02 7.26 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.869 0.366 . . . . 999.99 111.278 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -114.3 123.35 49.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.322 -0.399 . . . . 280.85 110.154 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -61.87 -39.48 92.06 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.399 -0.364 . . . . 999.99 111.213 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.75 -38.41 81.66 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.144 -0.48 . . . . 200.79 111.616 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -71.25 -25.48 62.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 518.33 111.438 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.08 -40.11 96.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.276 -0.42 . . . . 524.44 112.115 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -72.82 -27.19 24.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 120.782 -0.367 . . . . 407.88 111.633 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.87 93.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.326 0.584 . . . . 136.03 109.631 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.8 mt -64.08 -41.16 97.41 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.123 -0.944 . . . . 505.3 111.206 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.41 -40.15 93.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.992 -0.549 . . . . 703.51 111.788 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.404 ' O ' HG22 ' A' ' 24' ' ' ILE . 78.6 t -64.51 -45.95 94.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.582 -0.281 . . . . 324.41 111.51 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.86 -41.15 75.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.958 0.355 . . . . 685.46 111.958 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.503 HG22 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -66.95 -44.8 88.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.404 -0.362 . . . . 238.49 111.933 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.404 HG22 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -63.18 -32.74 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 111.964 0.357 . . . . 509.15 111.964 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.66 -45.95 92.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.407 -0.36 . . . . 183.06 111.457 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.18 -41.94 91.73 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.753 -0.737 . . . . 63.82 112.617 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 43.8 m-85 -70.27 -28.05 64.91 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.74 0.274 . . . . 351.91 111.74 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.418 ' O ' HG21 ' A' ' 32' ' ' VAL . 35.3 t70 -76.72 -40.99 46.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.436 -0.209 . . . . 145.09 110.436 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -62.85 -44.56 95.81 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.622 -0.51 . . . . 999.99 109.622 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -38.64 96.65 Favored Glycine 0 C--N 1.335 0.489 0 CA-C-N 115.464 -0.789 . . . . 82.9 112.226 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 tp -64.09 -42.96 96.73 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.736 0.303 . . . . 392.81 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 28' ' ' ASP . 63.5 t -61.51 -45.26 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.983 -0.553 . . . . 455.7 110.598 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -62.5 -40.59 97.2 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.838 0.351 . . . . 756.66 110.473 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -63.13 -43.95 96.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.995 -0.548 . . . . 999.99 110.033 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.46 -37.93 87.85 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.698 -0.683 . . . . 373.99 111.214 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.71 -37.74 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.688 0.28 . . . . 811.35 111.579 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.6 t -87.33 -50.66 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 113.525 0.935 . . . . 461.27 113.525 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.492 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.9 m80 -101.9 -27.56 12.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.022 0.749 . . . . 575.93 113.022 -177.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -72.08 -11.7 75.0 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.07 -0.586 . . . . 226.53 113.401 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -60.85 -39.92 90.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.819 0.303 . . . . 999.99 111.819 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 76.6 p -97.85 -8.13 28.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.246 0.461 . . . . 432.8 112.246 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 97.2 mt -73.11 150.7 42.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.064 0.459 . . . . 844.62 111.819 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 m -72.72 161.86 30.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.753 -0.658 . . . . 316.62 110.642 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -59.48 -40.1 85.86 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.109 -0.496 . . . . 291.13 111.12 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.425 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 55.8 t -65.15 -43.46 95.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.415 . . . . 467.63 110.852 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.88 -39.96 94.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.269 -0.423 . . . . 430.34 111.054 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.32 -47.18 87.13 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.277 -0.419 . . . . 667.57 110.795 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.41 -38.61 90.46 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.277 -0.419 . . . . 527.8 111.399 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.53 86.07 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.126 -0.488 . . . . 169.13 111.608 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -60.11 -30.67 69.42 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.171 -0.468 . . . . 409.47 111.99 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -62.35 -41.2 98.4 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.631 0.253 . . . . 686.82 110.769 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -66.58 -41.01 89.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.112 0.482 . . . . 213.85 110.122 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.477 HG12 ' CE2' ' A' ' 101' ' ' PHE . 62.6 t -60.86 -41.31 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 115.418 -0.81 . . . . 289.44 110.502 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.79 -42.15 88.35 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.928 -0.578 . . . . 358.19 110.506 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -63.28 -44.57 94.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.511 -0.313 . . . . 999.99 110.975 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -65.27 -42.41 93.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.989 0.423 . . . . 999.99 111.168 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -62.05 -44.43 96.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.535 -0.757 . . . . 212.58 110.499 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' HG22 ' A' ' 23' ' ' ILE . 9.0 ttp -59.4 -40.88 88.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.864 -0.607 . . . . 262.65 110.744 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.19 -42.54 99.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.169 -0.469 . . . . 684.75 111.365 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.4 p -71.39 -37.87 71.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.806 0.336 . . . . 450.86 111.116 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -63.99 -44.86 91.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.034 -0.53 . . . . 587.54 109.683 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 38.6 t-105 -61.74 -45.47 93.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.367 -0.833 . . . . 785.5 111.918 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.41 77.99 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.511 0.56 . . . . 290.18 112.511 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -62.13 -41.49 98.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.722 0.267 . . . . 676.15 111.722 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -82.52 -33.73 28.15 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.623 -0.262 . . . . 824.3 111.527 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.2 ttp -53.17 -43.93 67.46 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.988 -0.551 . . . . 839.61 112.02 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 98.1 mt -60.87 -41.41 95.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.295 -0.411 . . . . 667.86 111.339 -178.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -69.03 -39.74 79.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.473 -0.331 . . . . 999.99 111.299 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.95 -45.34 99.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.038 -0.528 . . . . 648.32 111.349 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -62.33 -37.13 84.45 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.235 -0.439 . . . . 555.82 112.103 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -60.89 -42.89 98.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.631 0.253 . . . . 912.86 110.931 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -67.41 -42.46 83.23 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.358 -0.383 . . . . 999.99 111.419 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.93 -47.04 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.307 -0.406 . . . . 322.08 111.168 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -63.05 -43.95 97.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.161 -0.472 . . . . 443.19 111.452 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.47 -40.77 98.0 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.471 -0.331 . . . . 427.97 111.859 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.1 mt -70.26 -41.34 73.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.953 0.406 . . . . 552.67 111.278 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.52 -10.61 71.13 Favored Glycine 0 CA--C 1.52 0.36 0 CA-C-N 116.05 -0.523 . . . . 282.78 112.779 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.5 mpt_? -75.22 149.25 38.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.672 0.273 . . . . 999.99 111.347 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 74.9 p -72.24 138.48 81.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.387 -0.37 . . . . 423.41 110.585 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.0 136.99 23.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.291 1.994 . . . . 262.13 112.748 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.7 m -104.37 155.14 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 322.52 111.243 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 79.6 t -63.58 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.17 -0.468 . . . . 195.73 111.169 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.63 97.7 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.745 -0.741 . . . . 116.64 112.608 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.38 -41.14 96.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.156 0.503 . . . . 397.23 109.807 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -63.0 -42.41 99.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.316 -0.856 . . . . 273.3 111.324 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -67.74 -36.2 80.13 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.9 -0.32 . . . . 391.43 110.932 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -62.83 -46.48 87.75 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.003 0.43 . . . . 999.99 110.01 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.27 -41.23 94.42 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.747 -0.661 . . . . 292.18 110.792 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.06 -41.07 99.67 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-N 115.97 -0.559 . . . . 65.97 112.413 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.455 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -62.26 -40.13 95.19 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.605 0.24 . . . . 184.99 110.95 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -66.98 -40.8 87.49 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.063 0.459 . . . . 381.14 110.467 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.5 mt -64.71 -41.5 92.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.562 -0.745 . . . . 354.06 111.031 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.09 -11.77 59.25 Favored Glycine 0 CA--C 1.52 0.384 0 CA-C-N 115.969 -0.559 . . . . 88.8 113.694 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 79.5 mtp85 -80.19 -10.96 59.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.069 0.434 . . . . 999.99 111.239 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.2 mmt85 -108.42 129.3 55.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.924 0.392 . . . . 999.99 110.925 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.83 -76.87 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.438 . . . . 458.46 111.093 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.1 t0 55.79 49.01 17.01 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.999 0.428 . . . . 388.05 111.649 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.6 mtm -86.52 -2.34 58.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.244 -0.435 . . . . 538.07 111.531 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.15 89.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.172 -0.467 . . . . 282.7 111.919 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -62.89 -39.02 93.2 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.257 -0.429 . . . . 999.99 111.868 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.477 ' CE2' HG12 ' A' ' 53' ' ' VAL . 86.7 t80 -58.97 -47.19 86.01 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.821 0.343 . . . . 504.74 110.736 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -59.75 -47.68 84.69 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.002 -0.544 . . . . 999.99 110.733 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.42 -39.21 89.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.039 -0.528 . . . . 558.87 110.931 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.41 95.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.152 -0.476 . . . . 412.73 111.317 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.24 -43.02 99.78 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.606 -0.27 . . . . 665.66 110.692 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.7 -44.39 93.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.226 -0.443 . . . . 999.99 110.721 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.45 -43.26 88.75 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.777 -0.647 . . . . 746.24 111.769 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -87.91 -5.16 58.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.385 -0.371 . . . . 999.99 111.647 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.16 43.68 26.37 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.935 0.494 . . . . 848.93 111.187 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.1 103.75 13.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.318 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -94.59 117.81 66.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.007 -0.542 . . . . 586.78 110.334 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.43 138.68 33.15 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.29 1.993 . . . . 310.73 112.887 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -86.27 144.27 27.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.935 -0.575 . . . . 866.09 110.957 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.425 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 47.0 t80 -68.95 99.17 1.03 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.728 0.299 . . . . 999.99 111.214 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.9 mt -98.74 123.34 50.06 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.419 -0.355 . . . . 579.24 110.975 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.81 -34.27 84.43 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.165 2.576 . . . . 684.25 112.479 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.98 -43.87 94.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.901 -0.59 . . . . 662.15 111.334 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.77 -41.14 90.4 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.474 -0.33 . . . . 999.99 110.535 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -61.77 -42.1 98.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.958 -0.565 . . . . 675.31 110.327 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.48 -43.42 98.86 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.003 -0.544 . . . . 900.95 111.452 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.91 -46.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.76 0.314 . . . . 500.83 111.001 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -62.5 -40.8 97.89 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.098 -0.501 . . . . 834.99 111.378 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 67.4 ttp85 -64.86 -34.84 79.32 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.188 -0.46 . . . . 999.99 111.826 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.9 mtp -72.89 134.49 44.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.949 0.404 . . . . 599.62 111.753 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -53.85 145.05 33.57 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.517 -0.765 . . . . 999.99 111.3 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.57 -38.5 83.88 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.969 2.446 . . . . 214.74 112.942 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.45 75.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.572 . . . . 248.66 112.114 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -90.03 -15.0 32.71 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.205 0.817 . . . . 360.37 113.205 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 9.0 p -105.03 130.95 22.26 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 120.501 -0.479 . . . . 334.76 111.441 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -61.3 147.24 96.08 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.816 2.344 . . . . 351.83 112.491 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.2 m -126.3 152.31 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.211 -0.45 . . . . 410.42 110.394 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -118.84 127.7 53.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 999.99 110.992 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -84.49 80.54 9.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.037 -0.529 . . . . 551.94 110.478 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.6 mtp . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.1 -0.953 . . . . 965.93 111.106 -179.646 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.4 t . . . . . 0 C--O 1.232 0.179 0 N-CA-C 109.83 -0.433 . . . . 521.04 109.83 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.07 149.18 65.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 110.411 -0.218 . . . . 999.99 110.411 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.82 136.04 37.34 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.085 1.857 . . . . 546.56 112.367 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -120.63 -38.81 2.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.586 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -103.1 2.39 34.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.791 0.293 . . . . 999.99 111.791 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.1 tp -57.91 124.12 18.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.754 0.312 . . . . 999.99 110.743 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -113.26 120.1 40.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 280.85 110.495 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -62.1 -37.95 87.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 999.99 111.068 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.24 82.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.191 -0.458 . . . . 200.79 111.587 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -77.74 -20.39 53.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 518.33 110.976 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.39 -42.56 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 524.44 111.612 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.02 -32.55 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 120.961 -0.296 . . . . 407.88 111.685 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.57 -44.32 96.63 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.114 0.483 . . . . 136.03 110.252 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.9 mt -69.51 -38.2 77.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.475 -0.784 . . . . 505.3 111.329 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -59.03 -41.92 88.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.548 -0.751 . . . . 703.51 111.794 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.01 -44.69 99.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.527 0.204 . . . . 324.41 111.116 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.88 -40.78 91.92 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.82 0.343 . . . . 685.46 111.148 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.72 -42.78 95.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.913 -0.585 . . . . 238.49 111.503 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 86.8 mt -60.21 -42.5 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.391 -0.368 . . . . 509.15 111.621 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.87 94.89 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.079 -0.248 . . . . 183.06 111.42 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.69 94.16 Favored Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.876 -0.678 . . . . 63.82 112.578 178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -73.12 -18.34 61.3 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 122.762 0.425 . . . . 351.91 112.009 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.04 -38.96 61.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.787 0.291 . . . . 145.09 111.787 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -66.19 -32.3 73.65 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 120.516 -0.474 . . . . 999.99 110.11 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.96 -39.16 97.72 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 115.683 -0.69 . . . . 82.9 112.138 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.77 -39.28 93.87 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.55 0.214 . . . . 392.81 110.876 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.492 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 69.6 t -61.03 -46.73 96.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.16 -0.473 . . . . 455.7 111.095 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -64.23 -41.5 96.97 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.908 0.385 . . . . 756.66 110.979 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.552 ' O ' HG12 ' A' ' 37' ' ' VAL . 76.5 t90 -65.46 -43.33 90.7 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.404 0.621 . . . . 999.99 110.39 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.46 -33.19 73.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.187 -0.915 . . . . 373.99 112.487 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 32' ' ' VAL . 99.4 mtt180 -58.24 -28.49 64.95 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.38 0.881 . . . . 811.35 113.38 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.552 HG12 ' O ' ' A' ' 34' ' ' TRP . 8.6 p -84.5 -26.33 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.667 -0.413 . . . . 461.27 112.022 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -111.2 15.28 21.58 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.65 0.262 . . . . 575.93 111.257 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -39.81 97.81 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.066 -0.515 . . . . 226.53 114.293 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -65.12 -23.23 67.08 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.606 0.595 . . . . 999.99 112.606 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.6 p -112.83 11.65 19.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.046 0.387 . . . . 432.8 112.046 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -71.9 122.49 20.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 844.62 112.041 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 71.1 m -80.53 159.21 25.58 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.963 -0.562 . . . . 316.62 110.033 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -61.73 -43.77 98.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.659 0.266 . . . . 291.13 111.639 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -73.22 -31.22 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 111.7 0.259 . . . . 467.63 111.7 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -62.8 -38.54 91.09 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.784 0.29 . . . . 430.34 111.784 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -59.77 -46.26 89.74 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.732 0.301 . . . . 667.57 110.388 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.42 -39.0 91.6 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.221 -0.445 . . . . 527.8 110.396 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.53 -36.54 80.84 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.549 -0.75 . . . . 169.13 111.849 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.21 -36.68 78.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.372 -0.376 . . . . 409.47 111.904 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -61.22 -39.61 90.9 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.471 -0.566 . . . . 686.82 109.471 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.72 -39.84 88.18 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.757 -0.656 . . . . 213.85 109.776 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 63.2 t -60.11 -39.15 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.142 0 CA-C-N 115.741 -0.663 . . . . 289.44 110.461 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -56.88 -47.05 81.37 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.327 -0.397 . . . . 358.19 110.799 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.97 -40.56 91.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.664 -0.244 . . . . 999.99 110.756 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -62.07 -45.49 93.28 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.056 0.455 . . . . 999.99 110.111 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -60.44 -47.04 87.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.571 -0.74 . . . . 212.58 110.157 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -46.9 88.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 262.65 111.474 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -62.85 -43.44 98.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.005 0.372 . . . . 684.75 112.005 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.426 HG22 ' SD ' ' A' ' 134' ' ' MET . 41.3 p -71.57 -40.42 69.95 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.797 0.295 . . . . 450.86 111.797 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.437 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 61.1 t-80 -64.13 -47.56 79.47 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.875 0.369 . . . . 587.54 110.548 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -63.74 -44.15 94.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.747 -0.661 . . . . 785.5 112.081 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.64 83.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.796 0.665 . . . . 290.18 112.796 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -64.62 -40.89 96.29 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.921 0.341 . . . . 676.15 111.921 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.437 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 79.8 m-85 -81.49 -26.78 34.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.757 0.28 . . . . 824.3 111.757 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.5 ttp -52.54 -41.6 63.67 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.051 -0.522 . . . . 839.61 112.072 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.78 -44.61 90.7 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.663 -0.244 . . . . 667.86 111.494 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.6 m0 -67.36 -41.15 85.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 999.99 110.818 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 47.5 mm -67.37 -45.41 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 115.95 -0.568 . . . . 648.32 111.047 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.16 -41.93 97.65 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.949 -0.569 . . . . 555.82 111.47 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -60.18 -45.55 92.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.435 -0.348 . . . . 912.86 110.63 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.62 -42.66 95.36 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.402 -0.363 . . . . 999.99 111.269 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -63.8 -46.92 93.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.813 0.34 . . . . 322.08 111.164 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.43 -40.81 97.77 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.257 -0.429 . . . . 443.19 111.312 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.46 95.92 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.374 -0.375 . . . . 427.97 111.419 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.1 mt -69.77 -40.47 76.05 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.341 -0.39 . . . . 552.67 111.341 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 -8.22 79.59 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.044 -0.598 . . . . 282.78 112.507 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -74.76 153.06 38.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 999.99 111.707 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -108.53 95.96 17.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.008 -0.542 . . . . 423.41 110.651 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.89 147.61 55.96 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.552 2.168 . . . . 262.13 113.282 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -101.07 -175.37 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.615 -0.721 . . . . 322.52 111.142 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.3 t -58.77 -41.97 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.404 -0.362 . . . . 195.73 110.718 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.612 ' O ' HG23 ' A' ' 86' ' ' THR . . . -60.57 -40.62 98.1 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.658 -0.782 . . . . 116.64 112.181 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.15 -40.58 90.7 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 397.23 110.692 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -69.18 -36.26 77.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.705 -0.68 . . . . 273.3 112.174 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.612 HG23 ' O ' ' A' ' 83' ' ' GLY . 0.8 OUTLIER -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.638 0.236 . . . . 391.43 111.638 -179.089 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.21 -46.34 89.35 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.722 -0.473 . . . . 999.99 109.722 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.71 -39.82 84.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.582 -0.735 . . . . 292.18 110.423 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.66 99.2 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 115.717 -0.674 . . . . 65.97 112.436 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.77 -41.22 97.42 Favored 'General case' 0 C--N 1.335 -0.064 0 CA-C-O 120.745 0.307 . . . . 184.99 110.498 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.48 -40.06 95.46 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.039 -0.528 . . . . 381.14 110.596 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 37.4 mm -63.28 -43.65 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.948 -0.569 . . . . 354.06 110.383 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 -20.61 66.84 Favored Glycine 0 CA--C 1.521 0.457 0 CA-C-N 115.873 -0.603 . . . . 88.8 113.609 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 42.0 mmt180 -79.73 -16.12 56.22 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.939 0.369 . . . . 999.99 111.384 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 -107.7 111.72 24.06 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.015 -0.365 . . . . 999.99 110.015 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -125.44 125.33 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.412 -0.358 . . . . 458.46 110.164 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.6 70.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.986 0.422 . . . . 388.05 110.888 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.82 -29.01 66.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.885 -0.598 . . . . 538.07 110.764 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.03 79.88 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.532 -0.758 . . . . 282.7 111.405 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.44 -46.98 85.45 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.113 -0.494 . . . . 999.99 111.064 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.488 ' CE2' HD12 ' A' ' 105' ' ' LEU . 89.4 t80 -58.27 -48.17 81.29 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.781 0.324 . . . . 504.74 110.728 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.69 -47.96 83.92 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.995 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -62.2 -39.08 91.55 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.055 -0.52 . . . . 558.87 111.609 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.47 94.57 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.384 -0.371 . . . . 412.73 111.265 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.488 HD12 ' CE2' ' A' ' 101' ' ' PHE . 90.2 mt -63.33 -40.83 98.37 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.304 -0.407 . . . . 665.66 110.667 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -64.7 -40.18 94.93 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.008 -0.542 . . . . 999.99 110.903 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.32 -43.36 88.16 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.882 -0.599 . . . . 746.24 111.525 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt -87.19 -6.92 58.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.472 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 56.42 37.24 28.65 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.956 0.502 . . . . 848.93 111.334 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.8 ttp -116.89 117.37 29.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 999.99 111.311 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.75 119.54 65.96 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.051 -0.522 . . . . 586.78 110.224 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.07 138.87 87.91 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.515 2.143 . . . . 310.73 112.33 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -85.49 119.52 25.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.414 -0.357 . . . . 866.09 110.966 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -70.01 89.84 0.62 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.068 -0.514 . . . . 999.99 110.562 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 86.4 mt -97.8 141.93 23.76 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 112.006 0.372 . . . . 579.24 112.006 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.6 -33.04 97.88 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.237 2.625 . . . . 684.25 112.575 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -59.72 -44.54 93.68 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.077 -0.51 . . . . 662.15 111.203 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 65.6 mtt -60.51 -40.2 90.55 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.798 -0.445 . . . . 999.99 109.798 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.94 -40.57 96.0 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.619 -0.718 . . . . 675.31 110.444 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.14 -39.79 94.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.694 -0.685 . . . . 900.95 111.072 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.3 mt -61.09 -43.64 96.67 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.434 -0.348 . . . . 500.83 110.73 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.77 -37.78 83.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.258 -0.428 . . . . 834.99 110.336 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -64.11 -33.39 75.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.64 . . . . 999.99 110.758 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 69.6 mtm -68.47 140.0 55.72 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.462 -0.335 . . . . 599.62 110.956 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG21 ' A' ' 129' ' ' VAL . 55.6 mmm-85 -52.46 137.48 41.09 Favored Pre-proline 0 N--CA 1.465 0.302 0 CA-C-N 115.892 -0.595 . . . . 999.99 111.51 178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -35.13 79.01 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.316 2.677 . . . . 214.74 113.229 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.1 77.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 248.66 112.106 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.75 -1.98 57.83 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.87 0.322 . . . . 360.37 111.87 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 125' ' ' ARG . 68.7 t -98.59 115.75 65.66 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.679 0.276 . . . . 334.76 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.57 156.09 61.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.671 2.247 . . . . 351.83 112.473 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.5 p -106.89 139.78 27.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 410.42 110.448 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -107.87 131.88 54.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.057 0.456 . . . . 999.99 110.879 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -83.95 156.71 22.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.848 -0.614 . . . . 551.94 110.733 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.426 ' SD ' HG22 ' A' ' 60' ' ' THR . 78.2 mmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.425 -0.798 . . . . 965.93 111.045 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 C--O 1.233 0.236 0 N-CA-C 110.234 -0.284 . . . . 521.04 110.234 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.05 149.82 70.61 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.881 0.372 . . . . 999.99 111.376 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.25 161.21 45.15 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.052 2.501 . . . . 546.56 113.076 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.0 mttp 67.42 17.32 10.1 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.428 -0.805 . . . . 999.99 112.258 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -62.28 -50.09 73.08 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.079 0.466 . . . . 999.99 110.378 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.06 139.84 56.43 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.411 -0.813 . . . . 999.99 111.245 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -61.69 129.83 42.95 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.396 -0.365 . . . . 280.85 110.293 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -63.24 -20.34 65.36 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.556 0.576 . . . . 999.99 112.556 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.3 -39.09 81.91 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.75 0.309 . . . . 200.79 111.632 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -68.37 -30.45 69.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 518.33 110.885 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.25 -39.68 94.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 524.44 110.76 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.6 -48.98 86.26 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-N 116.148 -0.478 . . . . 407.88 111.386 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.25 -41.69 99.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.023 -0.535 . . . . 136.03 111.433 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.495 HD22 ' CE2' ' A' ' 85' ' ' TYR . 51.6 tp -66.5 -41.42 88.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 505.3 111.392 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -59.28 -35.24 73.4 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.952 -0.567 . . . . 703.51 112.054 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.17 -44.15 98.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.822 0.344 . . . . 324.41 110.291 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -69.97 -38.57 76.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.961 0.41 . . . . 685.46 110.465 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.427 HG21 HD12 ' A' ' 23' ' ' ILE . 88.8 mt -61.05 -47.09 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.765 0.654 . . . . 238.49 112.765 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 32.9 pt -60.26 -36.22 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 112.775 0.657 . . . . 509.15 112.775 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.91 -46.22 90.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.665 0.269 . . . . 183.06 111.361 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.67 -41.14 89.95 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 121.138 -0.554 . . . . 63.82 112.888 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -73.62 -21.09 60.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.268 . . . . 351.91 111.704 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.468 ' O ' HG21 ' A' ' 32' ' ' VAL . 16.3 t70 -77.12 -40.23 46.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.684 -0.235 . . . . 145.09 110.705 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.07 -42.38 99.65 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.001 0.429 . . . . 999.99 109.954 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.402 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -65.48 -39.59 95.74 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.639 -0.709 . . . . 82.9 111.773 178.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.9 -41.62 98.12 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 115.64 -0.28 . . . . 392.81 110.768 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 28' ' ' ASP . 64.4 t -60.72 -42.77 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.18 -0.464 . . . . 455.7 111.115 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -61.39 -41.56 97.32 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.608 -0.269 . . . . 756.66 111.21 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.402 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 1.8 m-90 -74.24 -37.3 63.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.036 0.446 . . . . 999.99 110.94 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.3 tp -64.31 -41.85 96.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.945 -0.571 . . . . 373.99 112.039 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -66.18 -23.0 66.38 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.192 0.812 . . . . 811.35 113.192 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.1 m -98.21 -20.0 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 112.991 0.737 . . . . 461.27 112.991 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -109.35 -27.41 9.52 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.879 -0.328 . . . . 575.93 111.666 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.95 -26.33 60.65 Favored Glycine 0 C--N 1.331 0.265 0 CA-C-N 115.801 -0.636 . . . . 226.53 114.38 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -66.4 -22.49 66.23 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.558 0.679 . . . . 999.99 111.36 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 66.1 p -112.55 -20.67 11.65 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.234 0.457 . . . . 432.8 112.234 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.1 mt -73.09 147.32 45.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.122 0.487 . . . . 844.62 112.093 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -75.97 163.62 26.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 316.62 109.75 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.3 m -58.88 -42.31 89.2 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.826 0.346 . . . . 291.13 110.893 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 63.2 t -66.09 -42.23 91.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.311 -0.404 . . . . 467.63 110.581 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.25 -40.21 96.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.147 -0.479 . . . . 430.34 111.455 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.14 -41.99 99.39 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.661 0.267 . . . . 667.57 110.83 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.37 -39.25 85.65 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.005 0.431 . . . . 527.8 110.374 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 118' ' ' MET . . . -61.7 -36.16 80.1 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.556 -0.747 . . . . 169.13 111.105 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.78 -38.91 79.57 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.751 -0.659 . . . . 409.47 111.193 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -60.7 -40.52 92.52 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.836 0.35 . . . . 686.82 110.343 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -65.85 -40.65 91.91 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.92 -0.582 . . . . 213.85 109.968 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.512 HG12 ' CE2' ' A' ' 101' ' ' PHE . 55.1 t -60.82 -41.13 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 115.5 -0.773 . . . . 289.44 110.872 179.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -59.13 -42.73 91.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.312 -0.404 . . . . 358.19 110.598 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -65.03 -41.81 94.89 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.824 0.345 . . . . 999.99 110.519 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -63.41 -43.93 96.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.914 -0.585 . . . . 999.99 110.619 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -59.81 -48.34 82.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.704 -0.68 . . . . 212.58 111.039 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -61.16 -44.22 97.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.423 -0.353 . . . . 262.65 111.109 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.3 -43.21 99.34 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.113 0.412 . . . . 684.75 112.113 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.2 p -71.61 -41.16 69.26 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.959 -0.296 . . . . 450.86 111.571 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -63.22 -46.77 85.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.179 0.514 . . . . 587.54 110.179 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -63.83 -38.7 92.09 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.291 -0.868 . . . . 785.5 111.826 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.79 74.65 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.727 0.269 . . . . 290.18 111.727 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -60.87 -44.08 97.53 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.792 0.33 . . . . 676.15 110.302 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -70.6 -36.19 73.39 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.129 -0.487 . . . . 824.3 111.254 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 75.9 mmm -51.7 -35.22 41.93 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.065 -0.516 . . . . 839.61 112.261 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.29 -50.03 75.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.613 0.244 . . . . 667.86 111.168 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -69.45 -40.1 77.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.354 -0.385 . . . . 999.99 111.394 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.7 mm -64.78 -46.05 93.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.987 -0.551 . . . . 648.32 111.51 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.51 -43.09 99.67 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.368 -0.378 . . . . 555.82 111.23 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.59 -41.94 98.3 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.522 -0.308 . . . . 912.86 110.933 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.73 -47.1 85.02 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 999.99 110.83 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.69 -45.92 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.131 -0.486 . . . . 322.08 110.942 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.45 -45.1 94.58 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.227 -0.442 . . . . 443.19 111.684 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.66 98.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.654 -0.248 . . . . 427.97 111.594 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.4 tp -68.13 -45.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.152 0.501 . . . . 552.67 110.592 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.03 -23.02 31.27 Favored Glycine 0 C--N 1.331 0.278 0 CA-C-N 115.708 -0.678 . . . . 282.78 112.789 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -76.54 141.79 41.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.602 0.239 . . . . 999.99 110.932 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.3 p -82.0 134.41 49.71 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.579 -0.282 . . . . 423.41 110.702 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 154.95 46.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.66 2.24 . . . . 262.13 112.745 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -101.72 158.04 4.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.346 -0.388 . . . . 322.52 110.1 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.09 -45.0 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.391 -0.368 . . . . 195.73 111.97 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.457 ' O ' HG23 ' A' ' 86' ' ' THR . . . -61.26 -44.42 98.11 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.633 -0.794 . . . . 116.64 113.553 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.22 -41.62 69.95 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.956 0.378 . . . . 397.23 111.491 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.495 ' CE2' HD22 ' A' ' 19' ' ' LEU . 40.1 t80 -65.23 -39.68 93.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.094 -0.503 . . . . 273.3 111.582 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -60.46 -24.11 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.461 -0.336 . . . . 391.43 111.891 -179.604 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -62.41 -37.16 84.72 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.79 0.329 . . . . 999.99 110.887 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.67 -38.96 89.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.909 -0.587 . . . . 292.18 111.17 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.18 -39.3 96.97 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.916 -0.583 . . . . 65.97 113.101 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.09 98.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.633 0.254 . . . . 184.99 111.078 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.79 -40.09 95.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.116 -0.493 . . . . 381.14 110.85 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.5 mm -65.13 -42.71 95.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.772 -0.649 . . . . 354.06 110.953 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.54 -20.16 65.52 Favored Glycine 0 CA--C 1.52 0.388 0 CA-C-N 116.015 -0.539 . . . . 88.8 113.603 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -78.65 -24.52 45.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.037 0.418 . . . . 999.99 111.849 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.85 112.15 24.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 999.99 111.352 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.5 pt -134.69 153.47 35.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.325 -0.398 . . . . 458.46 110.757 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -147.17 55.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.053 0.454 . . . . 388.05 110.608 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.0 mtm -69.32 -28.81 66.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.78 -0.646 . . . . 538.07 111.711 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.16 88.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.286 -0.415 . . . . 282.7 111.717 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.15 -41.55 97.14 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.554 -0.293 . . . . 999.99 111.126 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.512 ' CE2' HG12 ' A' ' 53' ' ' VAL . 32.0 t80 -64.11 -43.89 93.94 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.697 -0.483 . . . . 504.74 109.697 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -60.11 -47.45 85.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.555 -0.748 . . . . 999.99 110.413 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -61.39 -40.51 94.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 558.87 110.694 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.04 96.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.094 -0.503 . . . . 412.73 111.37 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.92 -42.94 99.96 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.655 -0.248 . . . . 665.66 110.587 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -64.36 -42.99 95.92 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.029 -0.532 . . . . 999.99 110.932 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -57.97 -43.45 86.48 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.843 -0.617 . . . . 746.24 111.912 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -89.38 -4.91 57.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.547 -0.297 . . . . 999.99 111.47 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.5 t30 56.74 41.11 28.66 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.11 0.564 . . . . 848.93 111.226 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.3 mmm -108.04 101.76 10.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.342 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 76.1 mt -94.48 118.38 66.96 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.134 -0.485 . . . . 586.78 110.119 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.65 135.75 69.43 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.529 2.152 . . . . 310.73 112.754 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.49 143.37 28.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.202 -0.454 . . . . 866.09 110.673 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -68.86 108.05 3.31 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.903 0.382 . . . . 999.99 110.638 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.69 146.51 31.74 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.176 -0.465 . . . . 579.24 111.133 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -57.15 -38.38 95.61 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.886 2.391 . . . . 684.25 112.082 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -62.17 -39.43 92.67 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.64 -0.709 . . . . 662.15 110.871 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' MET . . . . . 0.549 ' O ' HG21 ' A' ' 121' ' ' ILE . 60.1 ttm -58.34 -46.38 86.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.103 -0.499 . . . . 999.99 110.236 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.12 -43.67 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.448 . . . . 675.31 110.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 124' ' ' MET . 96.6 mt-10 -65.14 -42.08 94.16 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.111 0.782 . . . . 900.95 113.111 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.549 HG21 ' O ' ' A' ' 118' ' ' MET . 15.3 tt -64.64 -28.68 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 111.816 0.302 . . . . 500.83 111.816 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -63.48 -35.82 81.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.875 0.369 . . . . 834.99 111.005 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.54 -1.67 57.82 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.862 -0.608 . . . . 999.99 112.239 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.499 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 66.1 mtt -88.18 128.88 35.45 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.719 0.295 . . . . 599.62 111.573 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.515 ' O ' HG21 ' A' ' 129' ' ' VAL . 40.5 mmt180 -53.51 142.52 40.57 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 115.939 -0.573 . . . . 999.99 110.758 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.46 -36.93 71.85 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.101 2.534 . . . . 214.74 113.283 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.17 -35.65 77.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 248.66 111.926 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -91.64 1.22 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.493 0.553 . . . . 360.37 112.493 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.515 HG21 ' O ' ' A' ' 125' ' ' ARG . 62.4 t -90.34 113.02 55.97 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 334.76 110.965 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.67 157.25 40.04 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.812 2.341 . . . . 351.83 112.761 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.75 157.55 30.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.361 -0.381 . . . . 410.42 110.398 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -132.08 145.86 51.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.059 0.457 . . . . 999.99 111.326 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.89 168.05 15.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 551.94 111.031 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.167 -0.92 . . . . 965.93 110.949 179.945 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.65 0.262 . . . . 521.04 110.897 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.4 147.32 63.77 Favored Pre-proline 0 C--O 1.234 0.277 0 CA-C-N 116.39 -0.368 . . . . 999.99 110.55 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.82 148.35 40.91 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.763 2.308 . . . . 546.56 113.299 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -73.76 135.32 43.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.808 -0.633 . . . . 999.99 109.652 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -77.85 93.29 4.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.419 . . . . 999.99 110.793 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.68 142.41 45.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.522 -0.763 . . . . 999.99 111.831 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.43 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 64.6 t30 -66.47 132.58 48.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.784 -0.45 . . . . 280.85 109.784 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.07 -40.52 93.99 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.657 -0.247 . . . . 999.99 111.655 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.29 -39.82 88.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 200.79 111.521 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -73.21 -28.37 62.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.208 -0.451 . . . . 518.33 111.004 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 12' ' ' ASN . 96.4 mt-10 -63.88 -39.96 95.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.296 0.48 . . . . 524.44 112.296 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 14' ' ' ALA . 34.6 m -69.57 -34.1 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 120.674 -0.41 . . . . 407.88 111.491 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.94 95.05 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.248 0.547 . . . . 136.03 110.277 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HG ' HD12 ' A' ' 23' ' ' ILE . 59.0 tp -69.34 -40.53 77.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.15 -0.932 . . . . 505.3 111.677 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' O ' HG12 ' A' ' 24' ' ' ILE . 65.0 tttm -59.74 -39.48 84.91 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.846 -0.616 . . . . 703.51 112.309 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 17' ' ' VAL . 70.7 t -62.54 -43.7 98.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.396 0.141 . . . . 324.41 111.019 -179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.89 -41.53 97.69 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.721 0.296 . . . . 685.46 110.855 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.405 HD12 ' HG ' ' A' ' 19' ' ' LEU . 97.1 mt -63.3 -44.55 99.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.063 -0.517 . . . . 238.49 110.873 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 20' ' ' LYS . 36.2 mm -60.68 -43.04 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 509.15 111.37 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.49 -42.84 97.14 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.8 -0.182 . . . . 183.06 111.397 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.97 -41.85 98.49 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.88 -0.676 . . . . 63.82 112.761 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -73.6 -23.8 59.97 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.885 0.328 . . . . 351.91 111.885 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -78.54 -30.17 46.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.464 -0.335 . . . . 145.09 111.427 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -62.79 -42.25 99.62 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.85 0.357 . . . . 999.99 110.83 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.96 -26.76 52.45 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.673 -0.775 . . . . 82.9 112.457 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.9 tp -65.55 -43.09 90.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.486 0.184 . . . . 392.81 111.393 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.36 -33.71 65.31 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 C-N-CA 121.015 -0.274 . . . . 455.7 111.336 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.62 -40.61 95.79 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 121.334 0.588 . . . . 756.66 109.701 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -64.91 -41.75 95.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.168 -0.923 . . . . 999.99 109.588 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.86 -37.04 83.01 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.228 -0.896 . . . . 373.99 111.146 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -62.43 -37.13 84.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.615 0.245 . . . . 811.35 111.42 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.86 -50.06 14.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 113.424 0.898 . . . . 461.27 113.424 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -107.51 -29.74 9.03 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.132 0.79 . . . . 575.93 113.132 -177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -69.19 -13.01 66.65 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.093 -0.575 . . . . 226.53 113.82 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -64.09 -22.04 66.77 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.87 0.335 . . . . 999.99 111.708 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.0 p -105.88 -15.35 14.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.953 0.406 . . . . 432.8 111.525 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -73.63 148.76 42.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 844.62 111.546 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -76.97 167.21 22.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.995 -0.548 . . . . 316.62 110.57 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -64.7 -32.07 73.58 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.987 0.366 . . . . 291.13 111.987 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.03 -39.77 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.958 0.408 . . . . 467.63 110.198 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.527 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 90.1 mt-30 -64.99 -41.32 95.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.829 -0.623 . . . . 430.34 110.879 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.27 -45.33 92.0 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.078 -0.51 . . . . 667.57 110.785 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.27 -38.45 91.08 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.716 -0.675 . . . . 527.8 110.823 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.02 85.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.887 -0.597 . . . . 169.13 111.528 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.449 ' O ' HG21 ' A' ' 53' ' ' VAL . 88.2 mt -62.24 -38.18 88.25 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.414 -0.357 . . . . 409.47 111.558 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -63.05 -39.01 93.45 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.306 -0.627 . . . . 686.82 109.306 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.401 ' CD2' ' HE3' ' A' ' 118' ' ' MET . 92.2 t80 -62.12 -48.06 81.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.344 -0.844 . . . . 213.85 111.608 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 50' ' ' LEU . 17.2 m -68.89 -24.16 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 C-N-CA 121.016 -0.273 . . . . 289.44 111.679 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.88 -41.37 91.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.53 -0.304 . . . . 358.19 110.569 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -62.96 -41.92 99.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.491 -0.322 . . . . 999.99 110.448 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -63.93 -44.03 94.1 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.166 0.507 . . . . 999.99 110.036 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -60.13 -47.47 85.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.226 -0.897 . . . . 212.58 111.113 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.428 ' O ' ' HB2' ' A' ' 62' ' ' TRP . 47.0 ttp -59.33 -45.46 91.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.995 -0.548 . . . . 262.65 111.068 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -64.7 -41.47 95.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.476 -0.329 . . . . 684.75 111.139 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -66.09 -45.5 80.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.22 -0.446 . . . . 450.86 110.787 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -64.38 -42.36 96.19 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.036 -0.529 . . . . 587.54 110.548 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . 0.428 ' HB2' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -60.11 -41.38 92.44 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.607 -0.724 . . . . 785.5 111.827 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.07 91.26 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.378 0.51 . . . . 290.18 112.378 -178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -62.55 -47.84 82.12 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.984 0.421 . . . . 676.15 111.014 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -68.46 -44.35 75.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.916 -0.584 . . . . 824.3 111.188 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.406 ' HB2' ' O ' ' A' ' 62' ' ' TRP . 0.0 OUTLIER -52.18 -39.11 59.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.566 -0.743 . . . . 839.61 112.893 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.39 -41.62 94.19 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.885 0.328 . . . . 667.86 111.885 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -68.09 -40.47 82.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.977 0.418 . . . . 999.99 110.69 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.413 ' O ' HG12 ' A' ' 73' ' ' ILE . 48.7 mm -70.62 -41.25 77.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.709 -0.678 . . . . 648.32 111.293 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -58.94 -40.95 86.2 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.033 -0.53 . . . . 555.82 111.694 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.91 -43.5 98.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.859 0.361 . . . . 912.86 110.541 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -66.58 -44.92 80.92 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.817 -0.629 . . . . 999.99 110.938 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.2 mm -64.38 -45.01 97.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 115.831 -0.622 . . . . 322.08 111.452 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -61.02 -43.79 98.36 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.309 -0.405 . . . . 443.19 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.21 -40.35 97.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.392 -0.367 . . . . 427.97 111.445 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -70.28 -40.54 74.27 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.422 -0.354 . . . . 552.67 111.486 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.63 -8.0 80.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.962 -0.637 . . . . 282.78 112.688 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -74.64 148.82 40.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 999.99 111.588 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.6 p -103.77 106.24 51.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 423.41 110.94 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.441 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 33.0 Cg_exo -60.91 143.88 99.45 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.138 2.559 . . . . 262.13 113.348 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -100.49 -175.78 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 322.52 110.996 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.39 -42.9 89.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-N 116.414 -0.357 . . . . 195.73 110.856 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.53 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -40.43 98.18 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.825 -0.702 . . . . 116.64 112.506 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -64.19 -42.26 96.75 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.851 0.357 . . . . 397.23 110.835 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.441 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 48.2 m-85 -71.16 -35.8 71.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.061 -0.518 . . . . 273.3 111.644 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -62.43 -35.93 80.8 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.575 0.226 . . . . 391.43 110.779 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -63.56 -45.03 92.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.248 0.547 . . . . 999.99 109.98 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -65.82 -40.66 92.03 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.47 -0.786 . . . . 292.18 110.483 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.87 -39.48 98.07 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 115.687 -0.688 . . . . 65.97 112.779 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.7 90.07 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.631 0.253 . . . . 184.99 111.198 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.83 -41.84 97.76 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.27 -0.423 . . . . 381.14 110.421 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.89 -42.26 91.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.744 -0.662 . . . . 354.06 111.171 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.49 -9.16 64.3 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.928 -0.578 . . . . 88.8 113.691 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.31 -30.4 54.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.906 0.384 . . . . 999.99 110.86 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -100.89 120.63 40.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 999.99 110.421 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 80.9 mt -116.48 119.72 62.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.528 -0.306 . . . . 458.46 110.773 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -110.97 24.66 12.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.299 -0.409 . . . . 388.05 111.946 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.7 mmm -61.71 -39.1 90.32 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.602 0.239 . . . . 538.07 111.28 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -39.25 90.13 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.035 0.445 . . . . 282.7 110.798 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -66.05 -35.98 82.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.026 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.465 ' CE2' HD12 ' A' ' 105' ' ' LEU . 87.5 t80 -58.9 -48.95 79.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.329 -0.396 . . . . 504.74 110.514 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -61.01 -47.8 84.74 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.922 -0.581 . . . . 999.99 110.798 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.56 -39.62 91.77 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.8 -0.636 . . . . 558.87 111.776 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.26 98.49 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.551 -0.295 . . . . 412.73 111.393 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.465 HD12 ' CE2' ' A' ' 101' ' ' PHE . 91.0 mt -64.79 -40.81 95.85 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.384 -0.371 . . . . 665.66 110.722 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.43 -43.68 96.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.892 -0.595 . . . . 999.99 111.096 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.85 -40.12 83.31 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.122 -0.49 . . . . 746.24 112.023 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -89.01 -7.24 56.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.587 -0.279 . . . . 999.99 111.287 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 52.9 t30 58.43 32.41 22.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.826 -0.625 . . . . 848.93 111.258 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 22.4 mmt -107.31 98.5 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.063 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.0 mt -94.24 119.67 66.3 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.022 -0.535 . . . . 586.78 110.514 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.36 150.85 65.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.454 2.102 . . . . 310.73 112.163 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -84.8 118.31 24.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.842 0.353 . . . . 866.09 110.56 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.527 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 23.7 m-85 -70.33 107.71 3.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.84 -0.618 . . . . 999.99 111.043 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 89.7 mt -97.72 143.5 26.33 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.605 -0.271 . . . . 579.24 111.264 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 51.5 Cg_exo -58.25 -35.07 99.07 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.071 2.514 . . . . 684.25 112.933 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -63.02 -34.18 77.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.25 -0.432 . . . . 662.15 111.027 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' MET . . . . . 0.401 ' HE3' ' CD2' ' A' ' 52' ' ' PHE . 95.8 mtp -60.17 -40.07 88.64 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.884 0.373 . . . . 999.99 110.129 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.03 -39.9 93.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.755 -0.657 . . . . 675.31 110.183 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.509 ' O ' ' HG3' ' A' ' 124' ' ' MET . 88.5 tt0 -62.92 -41.68 99.55 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.608 -0.723 . . . . 900.95 111.146 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.56 -42.37 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.813 0.34 . . . . 500.83 110.724 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.87 -38.57 82.54 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.08 -0.509 . . . . 834.99 111.129 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -77.71 -9.66 59.11 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.336 0.495 . . . . 999.99 112.336 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.509 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 68.1 mtt -71.54 139.22 49.39 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.653 0.264 . . . . 599.62 111.107 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -52.33 136.13 41.14 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.904 -0.589 . . . . 999.99 111.263 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -54.31 -36.88 88.13 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.039 2.493 . . . . 214.74 113.079 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -25.48 68.07 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.3 -0.409 . . . . 248.66 111.851 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -92.03 -1.77 57.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.455 -0.339 . . . . 360.37 111.383 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 60.1 t -99.94 112.98 64.93 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.669 -0.241 . . . . 334.76 110.745 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.23 152.58 61.73 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.501 2.134 . . . . 351.83 112.347 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.7 t -124.38 135.8 62.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 410.42 110.275 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -133.28 134.71 44.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.385 -0.371 . . . . 999.99 110.419 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -84.74 92.46 8.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.981 0.42 . . . . 551.94 110.371 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.282 -0.866 . . . . 965.93 111.345 -179.706 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.468 ' HB ' ' OD1' ' A' ' 70' ' ' ASN . 73.1 t . . . . . 0 C--O 1.232 0.177 0 N-CA-C 109.852 -0.425 . . . . 521.04 109.852 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -81.36 125.15 79.67 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.597 -0.274 . . . . 999.99 110.826 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.72 151.73 63.81 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.698 2.265 . . . . 546.56 112.788 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -132.76 134.89 45.31 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 999.99 109.722 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 63.81 33.67 12.55 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.582 0.551 . . . . 999.99 111.49 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.26 120.45 7.61 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.257 -0.429 . . . . 999.99 110.953 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -91.48 106.49 18.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.43 -0.35 . . . . 280.85 111.055 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.32 -22.11 66.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.93 -0.577 . . . . 999.99 111.819 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.44 81.43 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.804 0.335 . . . . 200.79 111.488 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -63.4 -37.29 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 518.33 109.98 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.76 -39.37 93.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.745 -0.661 . . . . 524.44 110.419 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.59 -46.92 95.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.812 -0.631 . . . . 407.88 111.285 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.01 99.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.22 -0.445 . . . . 136.03 111.256 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.21 -37.98 84.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.838 -0.619 . . . . 505.3 111.306 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.15 -39.7 83.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.736 -0.665 . . . . 703.51 111.586 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 74.1 t -62.82 -44.26 99.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.606 0.241 . . . . 324.41 110.657 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.82 -40.22 91.63 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.939 0.4 . . . . 685.46 110.744 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.07 -41.98 94.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.748 -0.66 . . . . 238.49 111.317 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.5 mt -60.05 -43.15 92.05 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.49 -0.323 . . . . 509.15 111.193 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -43.98 97.36 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.598 0.237 . . . . 183.06 111.228 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.48 -40.18 96.08 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.068 -0.587 . . . . 63.82 112.495 178.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -72.78 -20.49 61.16 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.384 0.273 . . . . 351.91 111.489 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.37 -36.42 60.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.535 -0.302 . . . . 145.09 110.557 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -60.84 -44.12 97.4 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.329 -0.619 . . . . 999.99 109.329 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.63 -39.07 97.43 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.475 -0.784 . . . . 82.9 112.215 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.529 HD21 ' SD ' ' A' ' 98' ' ' MET . 83.2 mt -62.14 -40.51 96.19 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.458 0.171 . . . . 392.81 111.058 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.4 t -60.96 -43.97 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.191 -0.459 . . . . 455.7 110.702 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.72 -44.6 96.42 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.147 -0.479 . . . . 756.66 111.02 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -68.03 -38.42 82.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.925 0.393 . . . . 999.99 110.179 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.6 mt -62.17 -37.0 83.56 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.929 -0.578 . . . . 373.99 111.611 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -61.87 -37.12 83.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.601 0.238 . . . . 811.35 111.543 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.5 t -87.82 -52.5 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 113.502 0.926 . . . . 461.27 113.502 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -115.36 -5.74 12.32 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.244 0.831 . . . . 575.93 113.244 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.86 93.27 Favored Glycine 0 N--CA 1.46 0.282 0 C-N-CA 121.29 -0.481 . . . . 226.53 113.685 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.8 ptm180 -62.01 -18.66 61.26 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.265 0.468 . . . . 999.99 112.265 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.5 p -106.15 1.07 25.9 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.409 0.522 . . . . 432.8 112.409 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.27 141.22 48.91 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.0 0.429 . . . . 844.62 111.962 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.0 m -77.78 162.77 26.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.746 -0.661 . . . . 316.62 110.495 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.9 m -60.02 -42.39 94.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.818 0.342 . . . . 291.13 110.96 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.89 -41.96 91.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.125 -0.488 . . . . 467.63 110.799 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.15 -40.91 98.94 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.21 -0.45 . . . . 430.34 111.178 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 64.2 tttm -61.47 -45.7 93.13 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.386 -0.37 . . . . 667.57 110.924 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.03 -38.72 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 527.8 111.019 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.21 -22.94 66.34 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.729 -0.668 . . . . 169.13 112.433 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -53.85 -36.27 62.4 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.384 0.512 . . . . 409.47 112.384 -179.303 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -62.41 -41.21 98.51 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.796 0.331 . . . . 686.82 110.785 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -70.43 -37.61 74.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 213.85 110.22 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.34 -41.22 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.669 -0.696 . . . . 289.44 111.014 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -59.99 -39.79 86.96 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.778 -0.192 . . . . 358.19 110.943 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -61.62 -46.15 91.04 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.789 0.328 . . . . 999.99 110.235 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -63.28 -41.72 99.03 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.979 -0.555 . . . . 999.99 110.61 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -61.77 -41.52 97.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.568 -0.742 . . . . 212.58 110.036 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 98.2 mtp -64.97 -38.55 91.32 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.961 -0.563 . . . . 262.65 111.364 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.03 -40.9 95.36 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.833 0.679 . . . . 684.75 112.833 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.462 ' HA ' ' SD ' ' A' ' 134' ' ' MET . 75.8 p -68.46 -38.85 81.48 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.694 -0.402 . . . . 450.86 111.371 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.476 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 69.9 m80 -70.7 -40.13 73.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.351 -0.386 . . . . 587.54 111.206 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -63.85 -39.84 95.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 785.5 112.206 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.73 90.65 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.828 0.307 . . . . 290.18 111.828 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -65.04 -46.86 79.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.828 0.347 . . . . 676.15 111.486 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.481 ' O ' HG12 ' A' ' 69' ' ' ILE . 62.7 m-85 -70.54 -40.52 73.35 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.346 -0.388 . . . . 824.3 112.025 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 17.7 tpt -53.76 -50.13 66.71 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.184 0.438 . . . . 839.61 112.184 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.95 -39.96 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.957 0.354 . . . . 667.86 111.957 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -61.99 -47.88 82.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 999.99 111.67 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.7 pt -80.11 -24.63 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.43 0.53 . . . . 648.32 112.43 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.468 ' OD1' ' HB ' ' A' ' 6' ' ' VAL . 28.6 t-20 -58.73 -45.52 89.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.613 0.227 . . . . 555.82 111.613 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.23 -41.73 96.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.548 -0.296 . . . . 912.86 111.237 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -70.06 -42.7 72.51 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.135 0.42 . . . . 999.99 112.135 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.83 -46.62 95.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.578 0.228 . . . . 322.08 111.433 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.58 -46.89 86.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.465 -0.334 . . . . 443.19 111.757 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.51 -41.16 96.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.171 0.434 . . . . 427.97 112.171 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.13 -40.6 71.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.875 0.369 . . . . 552.67 111.594 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.1 -8.23 78.93 Favored Glycine 0 CA--C 1.52 0.36 0 C-N-CA 121.042 -0.599 . . . . 282.78 112.287 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.8 mmt-85 -75.22 150.65 38.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.944 0.402 . . . . 999.99 111.546 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 p -107.42 100.98 36.86 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 423.41 110.634 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.508 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 46.0 Cg_exo -59.51 140.98 96.58 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.022 2.481 . . . . 262.13 113.398 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.29 -175.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.766 -0.652 . . . . 322.52 111.115 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.6 t -59.31 -41.6 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 116.375 -0.375 . . . . 195.73 110.909 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.604 ' O ' HG23 ' A' ' 86' ' ' THR . . . -60.38 -40.68 97.88 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.815 -0.707 . . . . 116.64 112.536 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -70.1 -42.29 72.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.018 0.437 . . . . 397.23 110.803 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.508 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 26.5 m-85 -68.0 -34.13 75.94 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.809 -0.632 . . . . 273.3 112.687 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.604 HG23 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -56.03 -32.57 64.13 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.686 0.254 . . . . 391.43 111.686 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -62.48 -45.42 93.11 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.05 0.453 . . . . 999.99 109.982 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.3 mt -66.12 -40.78 90.94 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.695 -0.684 . . . . 292.18 110.559 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.53 -40.64 99.37 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.661 -0.699 . . . . 65.97 112.364 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.91 -40.01 94.0 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.521 0.201 . . . . 184.99 110.836 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -63.44 -40.12 96.31 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.213 -0.449 . . . . 381.14 110.567 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.73 -42.69 96.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.996 -0.547 . . . . 354.06 110.517 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.33 -10.44 66.12 Favored Glycine 0 CA--C 1.522 0.488 0 CA-C-N 115.689 -0.687 . . . . 88.8 113.747 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.512 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.1 mmm180 -79.85 -13.92 59.05 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 117.107 0.454 . . . . 999.99 111.332 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -97.3 114.33 26.08 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.714 -0.476 . . . . 999.99 109.714 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.2 pt -121.8 23.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.325 -0.398 . . . . 458.46 111.817 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -81.64 77.94 8.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 388.05 111.034 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.529 ' SD ' HD21 ' A' ' 31' ' ' LEU . 67.4 mtt -91.75 -2.65 56.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.059 -0.519 . . . . 538.07 110.817 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.31 -37.3 82.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.819 -0.628 . . . . 282.7 110.898 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -58.64 -44.94 90.23 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.472 -0.785 . . . . 999.99 111.205 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.445 ' CE2' HD13 ' A' ' 105' ' ' LEU . 90.5 t80 -56.67 -48.3 77.91 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.443 -0.344 . . . . 504.74 111.285 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -65.0 -39.84 94.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 999.99 111.051 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.34 -41.8 98.9 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.064 -0.516 . . . . 558.87 110.69 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.82 92.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.929 -0.578 . . . . 412.73 111.466 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.445 HD13 ' CE2' ' A' ' 101' ' ' PHE . 88.3 mt -63.0 -42.07 99.75 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.43 -0.35 . . . . 665.66 110.862 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -63.72 -39.52 94.51 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 116.339 -0.392 . . . . 999.99 110.953 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.84 -39.8 82.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.063 -0.517 . . . . 746.24 111.545 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -84.56 -11.91 55.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.344 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.9 t30 54.38 42.96 31.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.953 -0.567 . . . . 848.93 111.524 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 63.3 tpp -127.87 118.64 24.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 999.99 111.107 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.0 mt -94.82 119.04 66.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 586.78 110.085 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.27 140.48 37.22 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.243 1.962 . . . . 310.73 112.83 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -85.88 150.39 24.56 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.063 -0.517 . . . . 866.09 110.846 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.61 125.27 25.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.784 0.326 . . . . 999.99 110.483 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.8 mt -98.96 145.61 30.26 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 579.24 111.336 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.86 -24.43 53.84 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.637 2.225 . . . . 684.25 111.97 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.85 -34.92 78.35 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.502 -0.772 . . . . 662.15 110.915 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.9 mtt -59.95 -39.5 85.78 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.091 -0.504 . . . . 999.99 110.483 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -61.44 -41.59 97.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.104 -0.498 . . . . 675.31 110.674 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -64.78 -42.18 95.28 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.074 -0.512 . . . . 900.95 110.828 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.8 mm -62.02 -46.65 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.088 -0.505 . . . . 500.83 111.07 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.5 -41.93 96.13 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.138 -0.483 . . . . 834.99 112.189 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -65.1 -35.81 82.31 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.448 0.536 . . . . 999.99 112.448 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.4 mtm -90.73 134.5 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.036 0.384 . . . . 599.62 112.036 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -53.09 146.13 21.41 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.755 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.24 -37.54 88.11 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.028 2.485 . . . . 214.74 112.949 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.77 -19.76 61.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.289 -0.414 . . . . 248.66 112.072 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -91.59 -21.67 20.71 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.185 0.439 . . . . 360.37 112.185 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.4 m -90.65 146.71 34.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.848 0.356 . . . . 334.76 111.306 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.53 156.73 53.75 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.702 2.268 . . . . 351.83 112.952 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.8 t -115.87 137.08 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.34 -0.615 . . . . 410.42 109.34 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -144.59 140.88 29.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.603 -0.271 . . . . 999.99 110.573 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -82.83 175.59 9.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.085 -0.507 . . . . 551.94 110.302 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 60' ' ' THR . 27.9 ptm . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.3 -0.857 . . . . 965.93 110.961 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 71.3 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.629 0.252 . . . . 521.04 110.354 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -82.46 147.44 56.25 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.477 -0.329 . . . . 999.99 110.901 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.71 152.41 47.66 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.73 2.287 . . . . 546.56 112.861 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -88.95 61.27 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.458 -0.337 . . . . 999.99 111.457 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 54.94 47.74 21.52 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.783 -0.644 . . . . 999.99 112.237 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.8 mt -56.68 142.27 40.68 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.322 -0.399 . . . . 999.99 111.064 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.37 114.06 19.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 280.85 111.102 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -64.12 -24.11 67.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.81 -0.632 . . . . 999.99 111.999 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.91 -39.16 84.48 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.885 0.374 . . . . 200.79 111.182 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -65.35 -34.88 79.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 518.33 109.965 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -64.15 -40.12 95.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.567 -0.742 . . . . 524.44 110.1 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.06 -46.87 95.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.774 -0.648 . . . . 407.88 111.186 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.04 -41.6 98.29 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.0 -0.546 . . . . 136.03 111.059 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -67.98 -41.03 82.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 505.3 111.428 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.98 -40.48 84.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.95 -0.568 . . . . 703.51 111.78 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.21 -43.78 98.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.726 0.298 . . . . 324.41 110.535 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.66 -39.12 91.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.393 . . . . 685.46 110.947 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.509 HG22 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -62.48 -42.37 95.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.153 -0.476 . . . . 238.49 110.603 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 91.9 mt -60.06 -41.14 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.693 -0.685 . . . . 509.15 111.642 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.51 -43.29 93.43 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.724 0.268 . . . . 183.06 111.724 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.44 -41.82 97.85 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.684 -0.77 . . . . 63.82 112.515 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -74.26 -18.29 60.75 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.963 0.357 . . . . 351.91 111.963 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -75.79 -31.49 59.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.401 -0.363 . . . . 145.09 110.908 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 32' ' ' VAL . 26.8 mmm180 -62.8 -39.71 95.08 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.366 -0.605 . . . . 999.99 109.366 178.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.65 -35.78 91.69 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.376 -0.829 . . . . 82.9 112.409 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.88 -42.77 99.46 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.078 0.399 . . . . 392.81 112.078 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 29' ' ' ARG . 33.5 m -74.23 -32.2 31.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 C-N-CA 120.651 -0.42 . . . . 455.7 111.298 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.09 -40.64 94.88 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.919 0.39 . . . . 756.66 110.576 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 59.0 t90 -66.44 -39.5 88.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.031 -0.532 . . . . 999.99 109.582 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.13 -37.04 83.65 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.561 -0.745 . . . . 373.99 111.071 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.18 -36.66 84.36 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.644 0.259 . . . . 811.35 111.464 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.04 -51.62 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 113.599 0.963 . . . . 461.27 113.599 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -108.55 -4.67 17.01 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.274 0.842 . . . . 575.93 113.274 -177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.28 -12.23 72.28 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.125 -0.559 . . . . 226.53 113.95 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -61.18 -40.22 93.09 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.818 0.309 . . . . 999.99 111.339 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.8 p -112.36 8.7 19.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.517 -0.31 . . . . 432.8 111.796 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.0 tp -71.46 131.69 43.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.373 -0.376 . . . . 844.62 111.32 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.0 t -70.54 152.34 44.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.136 -0.483 . . . . 316.62 110.732 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.7 m -59.88 -41.48 91.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.184 -0.462 . . . . 291.13 111.367 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -68.76 -37.35 77.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.885 0.374 . . . . 467.63 110.464 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.413 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 97.5 mt-30 -64.13 -38.28 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.973 -0.558 . . . . 430.34 111.073 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.04 -45.11 93.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 667.57 110.682 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -63.47 -40.4 97.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.003 0.43 . . . . 527.8 110.408 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.411 ' O ' HG22 ' A' ' 53' ' ' VAL . . . -62.17 -39.07 91.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.705 -0.68 . . . . 169.13 111.338 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.95 -44.13 94.58 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.932 -0.576 . . . . 409.47 111.78 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -62.21 -40.25 95.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 686.82 110.288 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -62.72 -44.78 95.35 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.129 -0.487 . . . . 213.85 110.012 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 49' ' ' ALA . 56.7 t -60.36 -40.43 83.96 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 CA-C-N 115.903 -0.589 . . . . 289.44 110.097 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.93 -45.34 90.63 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.387 -0.37 . . . . 358.19 110.714 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -64.27 -42.46 96.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.762 0.315 . . . . 999.99 110.859 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -63.85 -44.71 92.35 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.234 0.54 . . . . 999.99 110.099 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -60.71 -46.95 88.43 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.249 -0.887 . . . . 212.58 110.936 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.509 ' SD ' HG22 ' A' ' 23' ' ' ILE . 5.9 ttp -59.45 -44.59 92.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.181 -0.463 . . . . 262.65 110.955 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -64.33 -42.23 96.39 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.882 0.372 . . . . 684.75 110.731 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.1 m -64.72 -44.89 88.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.886 -0.597 . . . . 450.86 110.772 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -63.96 -44.92 91.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.783 -0.644 . . . . 587.54 110.268 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -62.06 -45.1 95.05 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.65 -0.704 . . . . 785.5 111.713 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.45 79.66 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.396 0.517 . . . . 290.18 112.396 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -61.07 -48.54 81.27 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.643 0.259 . . . . 676.15 110.85 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -71.63 -39.02 70.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.413 . . . . 824.3 111.612 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 28.1 ttt -52.16 -46.27 65.41 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.551 0.575 . . . . 839.61 112.551 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.66 -42.14 96.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.713 -0.221 . . . . 667.86 111.331 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -68.67 -40.14 80.28 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.977 0.418 . . . . 999.99 110.492 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.3 -44.13 98.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 115.6 -0.727 . . . . 648.32 110.496 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.85 -41.49 91.56 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.06 -0.518 . . . . 555.82 111.2 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.99 -42.33 99.02 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.53 -0.305 . . . . 912.86 110.682 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.9 -41.59 91.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.148 -0.478 . . . . 999.99 110.808 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -62.67 -46.23 96.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.911 -0.586 . . . . 322.08 110.663 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -61.59 -45.09 95.6 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.99 -0.55 . . . . 443.19 111.508 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.23 -41.01 99.05 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.47 -0.332 . . . . 427.97 111.764 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.94 -41.01 71.69 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.027 0.442 . . . . 552.67 111.345 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.33 -11.1 70.81 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.875 -0.602 . . . . 282.78 112.504 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.6 mpt_? -75.64 145.7 40.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.782 0.325 . . . . 999.99 111.432 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.424 ' O ' HG21 ' A' ' 79' ' ' THR . 7.0 t -91.6 116.53 66.63 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 121.009 0.433 . . . . 423.41 110.567 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.66 145.12 40.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.617 2.212 . . . . 262.13 113.304 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 m -102.07 178.47 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 322.52 110.849 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.0 t -60.83 -42.53 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.241 -0.436 . . . . 195.73 110.517 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.28 -39.58 96.24 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 121.107 -0.568 . . . . 116.64 112.777 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.91 -40.58 95.95 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.023 0.439 . . . . 397.23 110.259 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -67.44 -39.08 85.4 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.617 -0.719 . . . . 273.3 111.763 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.6 p -65.81 -34.81 79.03 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 111.9 0.333 . . . . 391.43 111.9 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -64.79 -41.54 95.76 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.005 0.431 . . . . 999.99 110.172 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -69.88 -40.5 75.65 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.698 -0.683 . . . . 292.18 110.623 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.8 -39.86 98.51 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.599 -0.728 . . . . 65.97 113.004 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.21 96.28 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.662 0.267 . . . . 184.99 111.135 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.67 -40.82 97.8 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.262 -0.426 . . . . 381.14 110.674 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.45 -42.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.811 -0.631 . . . . 354.06 110.865 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.95 -16.85 62.4 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.933 -0.576 . . . . 88.8 113.542 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -79.85 -13.82 59.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.864 0.332 . . . . 999.99 111.227 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -108.22 114.71 28.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 999.99 110.584 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.6 mt -125.52 118.59 52.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 458.46 110.471 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -106.02 19.27 20.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.544 -0.298 . . . . 388.05 111.789 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.0 mtp -62.29 -38.3 88.83 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.04 0.385 . . . . 538.07 112.04 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.1 -39.59 90.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.096 0.474 . . . . 282.7 110.551 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.75 -24.48 59.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.666 -0.697 . . . . 999.99 111.269 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -58.16 -48.71 79.45 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.14 -0.482 . . . . 504.74 110.995 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.09 -39.46 94.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.393 -0.367 . . . . 999.99 111.005 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.92 -44.9 95.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.195 -0.457 . . . . 558.87 110.903 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.76 -41.23 99.13 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.104 -0.498 . . . . 412.73 111.319 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.99 -45.12 86.92 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.159 -0.473 . . . . 665.66 111.258 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -64.61 -39.82 94.41 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.482 -0.326 . . . . 999.99 111.269 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.06 -43.89 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.162 -0.472 . . . . 746.24 111.99 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -91.38 -3.76 56.4 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.412 -0.358 . . . . 999.99 111.317 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.4 t30 57.53 37.44 27.66 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.235 0.614 . . . . 848.93 111.139 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 38.6 mmt -105.8 83.57 1.94 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.982 -0.554 . . . . 999.99 110.675 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.417 HD12 HG21 ' A' ' 111' ' ' ILE . 50.6 mm -94.51 116.67 66.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.458 -0.337 . . . . 586.78 110.789 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.37 157.68 45.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.728 2.285 . . . . 310.73 112.651 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -80.12 126.27 30.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.464 -0.335 . . . . 866.09 110.348 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.413 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 16.1 m-85 -70.03 90.96 0.66 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 999.99 111.33 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.7 145.31 29.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.485 -0.325 . . . . 579.24 110.477 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -79.51 45.3 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.493 2.129 . . . . 684.25 113.009 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -70.58 -29.22 65.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 662.15 110.393 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' MET . . . . . 0.491 ' O ' HG23 ' A' ' 121' ' ' ILE . 60.1 ttp -58.7 -43.31 90.02 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.608 -0.724 . . . . 999.99 111.113 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -61.11 -41.44 96.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.536 -0.302 . . . . 675.31 110.621 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.96 -41.22 82.78 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.011 -0.541 . . . . 900.95 111.911 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.491 HG23 ' O ' ' A' ' 118' ' ' MET . 7.7 tp -73.52 -28.32 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 111.707 0.262 . . . . 500.83 111.707 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -70.21 -17.43 63.14 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.614 -0.266 . . . . 834.99 111.698 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -65.04 -33.13 75.3 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.467 -0.333 . . . . 999.99 111.614 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.4 mtm -95.47 134.63 38.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.643 -0.253 . . . . 599.62 111.174 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.495 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.0 mtt-85 -52.53 139.34 39.0 Favored Pre-proline 0 N--CA 1.465 0.281 0 CA-C-N 116.203 -0.453 . . . . 999.99 110.851 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -60.22 -26.09 81.71 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.869 2.379 . . . . 214.74 113.274 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.71 -36.8 81.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 248.66 111.647 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -92.19 -1.2 57.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.389 -0.368 . . . . 360.37 111.961 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.5 t -87.15 120.5 71.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.684 0.278 . . . . 334.76 110.711 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.83 158.4 55.65 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.512 2.142 . . . . 351.83 112.311 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 88.0 t -106.0 137.59 35.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.207 -0.452 . . . . 410.42 110.109 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -78.93 116.56 19.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.023 0.44 . . . . 999.99 110.951 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -84.18 153.28 23.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.83 -0.623 . . . . 551.94 110.623 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.154 -0.927 . . . . 965.93 110.908 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.231 0.126 0 CA-C-O 121.02 0.438 . . . . 521.04 111.116 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.87 150.67 66.1 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.482 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HA ' ' OD2' ' A' ' 74' ' ' ASP . 50.5 Cg_endo -68.38 138.2 41.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.268 1.979 . . . . 546.56 112.687 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -102.59 -9.3 20.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.009 -0.542 . . . . 999.99 110.639 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -107.22 9.14 30.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 999.99 111.104 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -57.13 125.92 24.87 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.987 -0.551 . . . . 999.99 111.104 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -108.53 113.94 27.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.507 -0.315 . . . . 280.85 110.38 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 58.3 mtmt -62.48 -39.18 92.64 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.101 -0.5 . . . . 999.99 111.782 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.509 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -59.76 -39.72 85.8 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.936 0.398 . . . . 200.79 111.54 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -71.34 -29.31 64.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.24 -0.437 . . . . 518.33 110.72 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.409 ' OE1' ' HA ' ' A' ' 13' ' ' LYS . 54.3 mt-10 -64.62 -40.72 95.99 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.899 -0.592 . . . . 524.44 112.115 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 14' ' ' ALA . 27.8 m -68.7 -35.21 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 120.457 -0.497 . . . . 407.88 111.715 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.83 -41.55 95.98 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.002 0.43 . . . . 136.03 110.003 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 85' ' ' TYR . 58.1 tp -68.82 -40.42 79.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.691 -0.686 . . . . 505.3 111.132 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -60.23 -38.01 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.04 -0.527 . . . . 703.51 111.881 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.435 ' O ' HG23 ' A' ' 24' ' ' ILE . 69.0 t -63.04 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.622 0.249 . . . . 324.41 110.944 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.29 -41.52 89.68 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.644 0.259 . . . . 685.46 111.261 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.6 mt -70.09 -44.13 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.177 -0.465 . . . . 238.49 111.789 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.435 HG23 ' O ' ' A' ' 21' ' ' VAL . 6.3 tp -63.42 -33.9 64.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 CA-C-N 116.289 -0.414 . . . . 509.15 111.85 -178.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.57 -45.98 91.81 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.016 0.376 . . . . 183.06 112.016 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.28 -44.83 84.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.572 -0.823 . . . . 63.82 113.147 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -72.65 -18.66 61.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.194 0.442 . . . . 351.91 112.194 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.435 ' O ' HG21 ' A' ' 32' ' ' VAL . 34.2 t70 -74.8 -39.48 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.1 -0.24 . . . . 145.09 111.561 -178.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -63.84 -41.34 97.84 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.616 -0.434 . . . . 999.99 110.174 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -41.02 99.84 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.831 -0.622 . . . . 82.9 112.078 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.7 tp -63.53 -44.42 94.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.682 0.277 . . . . 392.81 110.367 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 28' ' ' ASP . 64.5 t -61.61 -44.6 98.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-N 116.11 -0.496 . . . . 455.7 110.813 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -62.24 -40.29 95.65 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.51 -0.314 . . . . 756.66 110.977 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -65.33 -42.01 93.38 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.398 -0.593 . . . . 999.99 109.398 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.431 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 86.6 mt -62.69 -35.49 79.88 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.271 -0.877 . . . . 373.99 111.296 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.94 -36.08 80.34 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.754 0.279 . . . . 811.35 111.754 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -86.31 -51.03 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 113.684 0.994 . . . . 461.27 113.684 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.613 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.2 m-70 -101.18 0.97 38.57 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 575.93 113.132 -177.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -60.88 -36.48 92.11 Favored Glycine 0 N--CA 1.461 0.327 0 N-CA-C 114.095 0.398 . . . . 226.53 114.095 -179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -58.94 -39.42 81.57 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.818 0.303 . . . . 999.99 111.818 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -89.76 -10.19 46.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.861 0.689 . . . . 432.8 112.861 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 88.1 mt -73.0 138.38 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.89 0.376 . . . . 844.62 111.79 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.6 p -78.16 169.11 18.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 316.62 110.011 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.98 -42.27 98.05 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.751 0.31 . . . . 291.13 110.972 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.69 -43.26 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 116.232 -0.44 . . . . 467.63 111.145 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -63.19 -40.29 97.07 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.104 0.409 . . . . 430.34 112.104 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -61.09 -46.15 91.8 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.68 0.276 . . . . 667.57 111.061 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -70.67 -37.66 73.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.352 -0.385 . . . . 527.8 111.101 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.9 -36.77 80.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 169.13 111.888 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.55 -37.08 80.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.056 0.391 . . . . 409.47 112.056 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -61.56 -38.96 89.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.62 -0.511 . . . . 686.82 109.62 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -66.99 -39.32 87.13 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.742 -0.663 . . . . 213.85 109.481 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.543 HG12 ' CE2' ' A' ' 101' ' ' PHE . 53.6 t -61.16 -39.6 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.544 -0.753 . . . . 289.44 111.062 179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -58.31 -42.33 86.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.436 -0.347 . . . . 358.19 110.731 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.4 ' NH2' HG22 ' A' ' 121' ' ' ILE . 94.9 mtm-85 -66.35 -39.35 89.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.152 -0.219 . . . . 999.99 110.46 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -63.51 -38.67 92.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.227 0.537 . . . . 999.99 109.751 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.72 -46.4 89.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.06 -0.973 . . . . 212.58 109.555 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 87.1 mtp -61.49 -42.99 99.63 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.768 -0.651 . . . . 262.65 110.865 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -62.72 -40.01 95.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.663 -0.699 . . . . 684.75 112.301 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -61.22 -49.32 77.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.734 0.302 . . . . 450.86 111.619 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -72.66 -39.31 67.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 587.54 111.92 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -64.58 -43.87 92.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 785.5 112.265 -178.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.64 -39.8 81.56 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.869 0.692 . . . . 290.18 112.869 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -60.8 -47.58 85.67 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.738 -0.21 . . . . 676.15 111.546 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -71.28 -42.44 68.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.703 0.287 . . . . 824.3 111.77 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 96.9 mmm -56.39 -41.82 76.91 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 113.494 0.924 . . . . 839.61 113.494 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.2 tp -58.99 -46.62 87.69 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.189 0.44 . . . . 667.86 112.189 -177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -65.63 -42.45 91.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.863 0.363 . . . . 999.99 111.267 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.2 mm -72.0 -43.77 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 116.016 -0.538 . . . . 648.32 112.098 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.35 -38.77 88.18 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.942 0.349 . . . . 555.82 111.942 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -59.96 -45.94 91.01 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.697 -0.483 . . . . 912.86 109.697 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.89 -40.97 92.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.894 -0.594 . . . . 999.99 110.972 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 92.5 mt -62.26 -48.09 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.34 -0.391 . . . . 322.08 111.2 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 8' ' ' PRO . 95.5 m-20 -63.39 -42.63 98.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 443.19 111.712 -179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.06 89.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 427.97 112.016 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -40.15 61.56 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.851 0.357 . . . . 552.67 111.55 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.28 -9.95 73.94 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.152 -0.547 . . . . 282.78 112.827 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -75.31 133.94 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.381 -0.229 . . . . 999.99 110.381 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.8 p -73.93 139.38 76.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.785 -0.189 . . . . 423.41 111.12 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.58 145.05 32.7 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.505 2.136 . . . . 262.13 113.203 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.7 m -102.68 170.23 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.936 -0.575 . . . . 322.52 110.854 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.92 -40.08 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.758 0.313 . . . . 195.73 110.461 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.1 -38.86 93.64 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.071 -0.513 . . . . 116.64 112.444 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -61.66 -42.71 99.28 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.96 -0.385 . . . . 397.23 109.96 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.419 ' O ' HD12 ' A' ' 19' ' ' LEU . 56.9 m-85 -66.3 -40.45 89.99 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.755 -0.657 . . . . 273.3 111.27 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.7 p -66.12 -32.98 74.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.595 0.22 . . . . 391.43 111.595 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -61.73 -46.07 91.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.405 -0.591 . . . . 999.99 109.405 178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.75 -40.74 88.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.465 -0.789 . . . . 292.18 110.347 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.61 -39.57 98.05 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.439 -0.8 . . . . 65.97 113.685 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -60.54 -40.48 91.7 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.695 0.283 . . . . 184.99 110.988 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.61 -40.5 95.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.981 -0.554 . . . . 381.14 110.241 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.73 -43.43 96.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.56 -0.746 . . . . 354.06 111.146 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.24 -13.92 63.18 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-N 115.824 -0.625 . . . . 88.8 114.001 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -79.38 -15.66 57.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.305 0.552 . . . . 999.99 111.479 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -108.66 111.81 23.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 999.99 110.93 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 77.4 mt -124.47 120.35 58.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.809 -0.441 . . . . 458.46 109.809 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -152.6 55.21 0.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 388.05 111.2 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.4 mmm -64.48 -38.83 92.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.009 -0.542 . . . . 538.07 111.704 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.38 89.37 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 282.7 111.675 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -60.02 -47.52 85.51 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.918 -0.583 . . . . 999.99 111.637 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.543 ' CE2' HG12 ' A' ' 53' ' ' VAL . 49.8 t80 -57.75 -45.73 85.49 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.122 0.264 . . . . 504.74 111.062 -179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.56 -48.13 82.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.569 0.223 . . . . 999.99 110.546 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.94 -41.69 99.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.417 -0.356 . . . . 558.87 110.98 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.48 94.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.101 -0.5 . . . . 412.73 111.055 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.461 HD12 ' O ' ' A' ' 110' ' ' MET . 59.6 tp -61.07 -43.79 98.35 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.652 -0.703 . . . . 665.66 110.587 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -62.96 -39.84 95.87 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.189 -0.46 . . . . 999.99 110.557 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.38 -40.36 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.741 -0.663 . . . . 746.24 111.503 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -82.74 -11.52 58.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.324 -0.398 . . . . 999.99 111.507 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.9 t30 54.89 44.91 27.59 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.527 0.517 . . . . 848.93 111.576 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' MET . . . . . 0.461 ' O ' HD12 ' A' ' 105' ' ' LEU . 66.9 mtt -115.39 83.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 999.99 110.878 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.417 HD12 HG23 ' A' ' 111' ' ' ILE . 49.8 mm -93.42 116.81 67.02 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.657 0.265 . . . . 586.78 110.642 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.54 150.31 45.56 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.718 2.279 . . . . 310.73 112.754 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -84.25 142.18 30.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 866.09 110.225 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -68.13 113.77 6.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 999.99 110.653 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -99.31 148.63 34.92 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.099 -0.5 . . . . 579.24 111.364 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.93 -19.2 58.33 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.841 2.361 . . . . 684.25 111.873 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -61.53 -35.88 78.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.743 . . . . 662.15 110.855 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 17.8 tpt -58.41 -42.23 86.72 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.081 -0.508 . . . . 999.99 110.574 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.17 -40.4 93.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.16 -0.473 . . . . 675.31 110.429 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -63.66 -42.31 98.1 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.115 -0.493 . . . . 900.95 111.031 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.4 HG22 ' NH2' ' A' ' 55' ' ' ARG . 32.0 mm -61.67 -45.14 99.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 116.433 -0.349 . . . . 500.83 110.807 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.968 -0.56 . . . . 834.99 111.524 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -67.6 -33.66 75.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.293 0.479 . . . . 999.99 112.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -80.3 137.36 36.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 599.62 112.034 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.473 ' O ' HG22 ' A' ' 129' ' ' VAL . 96.2 mtt-85 -53.5 144.04 34.28 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.413 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.46 -33.77 68.89 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.116 2.544 . . . . 214.74 112.86 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.457 ' HA ' ' CG1' ' A' ' 17' ' ' VAL . . . -60.75 -35.94 77.66 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.066 -0.515 . . . . 248.66 111.809 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -91.27 0.97 57.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.41 -0.359 . . . . 360.37 111.944 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 125' ' ' ARG . 57.5 t -96.0 111.15 55.25 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.779 0.323 . . . . 334.76 110.811 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -77.04 163.05 31.29 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.782 2.321 . . . . 351.83 112.969 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.4 m -120.9 153.92 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.053 -0.521 . . . . 410.42 109.857 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -116.75 124.06 48.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.041 0.448 . . . . 999.99 111.352 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -83.2 148.95 27.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 551.94 109.825 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.032 -0.985 . . . . 965.93 110.945 -179.503 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 C--O 1.231 0.095 0 N-CA-C 110.22 -0.289 . . . . 521.04 110.22 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -90.72 121.94 67.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.494 -0.321 . . . . 999.99 110.982 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -59.91 146.86 94.79 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.7 2.267 . . . . 546.56 112.06 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -61.64 -40.29 94.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.331 -0.395 . . . . 999.99 111.777 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -148.81 90.2 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.179 -0.208 . . . . 999.99 111.084 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 56.9 tp -58.98 122.91 14.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.276 -0.42 . . . . 999.99 110.381 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -101.43 102.65 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.921 0.391 . . . . 280.85 110.61 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -65.06 -38.51 91.04 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.799 -0.637 . . . . 999.99 112.052 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.71 84.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.043 0.386 . . . . 200.79 112.043 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.018 -0.364 . . . . 518.33 110.018 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -63.89 -40.58 96.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.875 -0.602 . . . . 524.44 110.456 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -62.18 -47.32 93.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.963 -0.562 . . . . 407.88 111.19 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.94 98.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 136.03 111.453 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' O ' HG13 ' A' ' 23' ' ' ILE . 85.3 mt -69.06 -39.01 79.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.273 0.471 . . . . 505.3 112.273 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -57.56 -42.85 83.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.861 1.06 . . . . 703.51 113.861 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.29 -37.23 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.211 -0.595 . . . . 324.41 111.232 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -70.89 -39.89 72.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 685.46 110.718 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.646 HG23 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -63.58 -43.64 98.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.672 -0.694 . . . . 238.49 111.177 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -59.64 -42.83 89.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.008 -0.542 . . . . 509.15 111.409 -178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.51 96.7 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.042 -0.263 . . . . 183.06 111.385 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.26 -42.87 93.92 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 120.898 -0.668 . . . . 63.82 112.938 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -73.37 -20.15 60.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.959 0.355 . . . . 351.91 111.959 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -77.17 -33.89 56.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.662 -0.245 . . . . 145.09 110.732 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -61.55 -42.71 99.23 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 109.807 -0.442 . . . . 999.99 109.807 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.19 -38.67 82.82 Favored Glycine 0 CA--C 1.519 0.293 0 CA-C-N 115.846 -0.615 . . . . 82.9 112.141 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.9 tp -62.87 -44.64 95.58 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.238 0.458 . . . . 392.81 112.238 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.62 -31.79 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 120.799 -0.36 . . . . 455.7 111.588 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -40.79 97.31 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.918 0.39 . . . . 756.66 109.964 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -64.03 -43.85 94.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.599 -0.728 . . . . 999.99 109.904 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.76 -37.58 84.81 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.176 -0.92 . . . . 373.99 111.575 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -68.31 -20.28 64.74 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.983 0.364 . . . . 811.35 111.983 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.1 t -84.09 -41.45 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.914 0.388 . . . . 461.27 111.136 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -103.92 19.08 20.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.884 0.373 . . . . 575.93 110.895 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.51 -35.88 82.13 Favored Glycine 0 N--CA 1.459 0.228 0 CA-C-N 115.529 -0.76 . . . . 226.53 114.122 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -59.74 -39.59 85.25 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.936 0.346 . . . . 999.99 111.936 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.2 p -110.24 12.22 23.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.66 0.615 . . . . 432.8 112.66 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.35 123.69 22.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 844.62 111.663 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HB2' ' HB2' ' A' ' 46' ' ' GLN . 70.7 m -78.67 154.66 29.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.092 -0.504 . . . . 316.62 110.491 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -61.1 -46.45 90.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.862 0.319 . . . . 291.13 111.862 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.5 t -73.01 -30.23 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 121.114 0.483 . . . . 467.63 110.452 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 43' ' ' SER . 64.6 tt0 -60.62 -38.98 86.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.462 -0.79 . . . . 430.34 111.27 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -59.29 -46.32 88.87 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 110.342 -0.244 . . . . 667.57 110.342 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.43 -39.4 92.06 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.987 0.422 . . . . 527.8 110.595 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.4 87.82 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.741 -0.663 . . . . 169.13 111.818 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.42 HD21 ' O ' ' A' ' 46' ' ' GLN . 1.8 mm? -57.42 -37.01 72.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.269 -0.423 . . . . 409.47 111.975 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -63.75 -40.75 97.46 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.736 0.303 . . . . 686.82 110.217 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.96 -43.55 92.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.968 -0.56 . . . . 213.85 109.94 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 68.6 t -61.19 -41.03 87.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.487 -0.779 . . . . 289.44 110.077 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -59.7 -42.72 93.64 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.91 -0.586 . . . . 358.19 110.272 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.71 -41.61 98.06 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.702 -0.227 . . . . 999.99 110.91 179.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -62.13 -45.54 93.02 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.024 0.44 . . . . 999.99 110.064 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -60.4 -45.92 91.83 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.602 -0.726 . . . . 212.58 110.156 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.646 ' SD ' HG23 ' A' ' 23' ' ' ILE . 30.3 ttp -58.81 -42.92 90.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.304 -0.862 . . . . 262.65 110.821 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.33 -42.35 98.97 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.276 -0.42 . . . . 684.75 111.832 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.3 p -71.55 -39.09 70.89 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 111.69 0.255 . . . . 450.86 111.69 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -64.25 -45.83 86.42 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.139 0.495 . . . . 587.54 110.406 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . 0.463 ' CZ2' HD13 ' A' ' 23' ' ' ILE . 13.3 m95 -65.78 -39.65 91.2 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.691 -0.686 . . . . 785.5 112.538 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -43.19 89.64 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.084 0.402 . . . . 290.18 112.084 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.03 -47.41 83.18 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.858 0.361 . . . . 676.15 111.108 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -68.38 -44.34 75.38 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.053 -0.521 . . . . 824.3 111.326 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.2 ttp -53.56 -46.03 70.09 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.752 -0.658 . . . . 839.61 112.195 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.9 mt -61.54 -39.88 92.65 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.716 0.265 . . . . 667.86 111.716 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -62.07 -47.79 83.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.448 -0.342 . . . . 999.99 111.656 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 pt -80.42 -28.09 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.671 0.619 . . . . 648.32 112.671 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -61.45 -40.2 93.65 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.526 0.203 . . . . 555.82 111.433 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.76 -42.18 98.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.488 -0.324 . . . . 912.86 110.592 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -67.96 -42.14 81.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 999.99 111.044 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.86 -46.91 92.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.291 -0.413 . . . . 322.08 111.063 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -63.37 -43.86 96.45 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.211 -0.449 . . . . 443.19 111.471 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.98 95.93 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.214 -0.448 . . . . 427.97 111.823 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.35 -40.68 67.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.473 -0.33 . . . . 552.67 111.173 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -8.17 79.55 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.89 -0.672 . . . . 282.78 112.706 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.0 mtp180 -74.23 142.83 45.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.787 0.327 . . . . 999.99 110.864 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.2 p -103.21 113.07 66.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.487 -0.324 . . . . 423.41 111.146 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.61 151.64 58.62 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.596 2.197 . . . . 262.13 112.829 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -100.68 178.52 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.938 -0.574 . . . . 322.52 111.512 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.5 t -59.71 -43.41 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.868 -0.606 . . . . 195.73 110.937 -179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.27 -40.84 97.93 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.789 -0.72 . . . . 116.64 112.463 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.001 0.429 . . . . 397.23 110.154 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -64.75 -39.08 93.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.618 -0.719 . . . . 273.3 112.044 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.9 p -65.87 -33.13 75.12 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.829 0.307 . . . . 391.43 111.829 -179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -61.94 -47.09 86.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.089 0.471 . . . . 999.99 109.969 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.9 mp -70.12 -40.25 74.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.728 -0.669 . . . . 292.18 110.575 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.68 -39.75 97.84 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.74 -0.664 . . . . 65.97 112.81 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.14 93.13 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.738 0.304 . . . . 184.99 110.887 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.23 -40.84 94.59 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.129 -0.487 . . . . 381.14 110.173 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.96 -43.11 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.818 . . . . 354.06 111.183 179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.59 -24.88 66.57 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 116.156 -0.475 . . . . 88.8 113.578 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -81.18 -12.67 59.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 0.329 . . . . 999.99 111.804 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.4 mmt180 -108.38 112.43 24.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.97 0.414 . . . . 999.99 111.366 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 pt -134.32 153.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 458.46 110.623 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -152.93 43.23 0.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.048 0.452 . . . . 388.05 110.664 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.7 mtp -65.23 -36.55 84.51 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.811 -0.631 . . . . 538.07 111.737 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.13 84.14 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.061 -0.518 . . . . 282.7 111.609 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -60.04 -48.41 81.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.551 -0.295 . . . . 999.99 110.694 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -43.53 98.55 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.274 -0.421 . . . . 504.74 110.338 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -47.83 84.25 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.807 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.36 -40.31 93.83 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.252 -0.431 . . . . 558.87 110.899 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.03 99.85 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.409 -0.359 . . . . 412.73 110.924 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.34 -40.81 94.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.048 -0.524 . . . . 665.66 110.663 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.97 -42.6 99.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.816 -0.629 . . . . 999.99 111.13 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.66 -42.39 83.44 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.97 -0.559 . . . . 746.24 111.744 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.0 1.77 56.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.524 -0.307 . . . . 999.99 111.352 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 57.96 41.65 24.1 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.237 0.615 . . . . 848.93 111.925 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.95 81.63 2.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.935 0.397 . . . . 999.99 110.513 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.2 mt -93.84 118.61 67.36 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.503 . . . . 586.78 110.401 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.82 149.11 53.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.598 2.199 . . . . 310.73 112.717 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.71 135.92 33.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.242 -0.436 . . . . 866.09 110.436 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.73 109.36 3.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.357 . . . . 999.99 111.014 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.0 mt -97.23 125.08 46.98 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 579.24 111.237 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.47 -31.96 80.33 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.277 2.651 . . . . 684.25 113.051 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -62.12 -36.52 81.99 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.371 -0.377 . . . . 662.15 111.091 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 61.1 mtt -60.31 -38.73 84.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.449 -0.341 . . . . 999.99 110.319 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.11 -39.44 89.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.932 -0.576 . . . . 675.31 110.291 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' A' ' 124' ' ' MET . 97.9 mt-10 -64.03 -40.15 95.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.999 -0.546 . . . . 900.95 110.909 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.6 mt -61.42 -41.79 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.022 0.439 . . . . 500.83 110.45 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -60.33 -37.34 80.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 834.99 110.89 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -74.74 -10.85 59.91 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.077 -0.511 . . . . 999.99 112.335 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 65.4 mtt -77.38 119.91 21.66 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.982 -0.287 . . . . 599.62 110.786 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -52.98 120.72 20.34 Favored Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 116.015 -0.538 . . . . 999.99 112.012 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -58.92 -35.83 97.93 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.884 2.39 . . . . 214.74 112.827 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.32 -37.07 85.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.695 0.628 . . . . 248.66 112.695 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -90.84 -22.07 21.16 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.432 0.53 . . . . 360.37 112.432 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 62.0 t -105.34 109.02 62.73 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 121.028 -0.269 . . . . 334.76 110.774 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.85 138.98 85.99 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.476 2.117 . . . . 351.83 112.463 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.414 HG13 ' N ' ' A' ' 132' ' ' LYS . 96.6 t -128.54 137.7 56.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.127 -0.488 . . . . 410.42 111.31 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . 0.414 ' N ' HG13 ' A' ' 131' ' ' VAL . 58.9 mtmt -122.9 147.72 46.27 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.218 -0.66 . . . . 999.99 109.218 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -83.52 125.72 32.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.727 0.298 . . . . 551.94 110.99 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.4 mtm . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.4 -0.81 . . . . 965.93 111.311 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.233 0.221 0 N-CA-C 109.913 -0.403 . . . . 521.04 109.913 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -80.94 119.31 75.68 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.281 -0.418 . . . . 999.99 111.046 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -59.69 144.9 99.34 Favored 'Trans proline' 0 C--N 1.35 0.605 0 C-N-CA 122.973 2.449 . . . . 546.56 111.854 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -120.35 151.42 39.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.822 0.344 . . . . 999.99 111.733 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 63.36 29.17 15.7 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.291 -0.868 . . . . 999.99 112.605 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -57.99 128.22 36.02 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.641 0.258 . . . . 999.99 111.078 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -114.07 114.74 26.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.594 -0.276 . . . . 280.85 110.414 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.76 -39.39 94.0 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.635 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.91 87.6 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.409 -0.359 . . . . 200.79 111.642 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -68.37 -31.37 70.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 518.33 110.398 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.76 -39.91 95.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.909 -0.587 . . . . 524.44 110.679 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.8 t -62.13 -46.81 95.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.013 0.435 . . . . 407.88 110.86 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.513 ' O ' HG21 ' A' ' 21' ' ' VAL . . . -62.53 -39.57 93.99 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.626 -0.715 . . . . 136.03 110.596 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.1 tp -64.27 -45.28 88.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.602 -0.726 . . . . 505.3 111.883 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -61.77 -40.75 96.27 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.259 0.837 . . . . 703.51 113.259 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 18' ' ' ALA . 34.4 m -66.65 -33.76 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.221 -0.591 . . . . 324.41 111.485 -179.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.05 -40.67 78.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.047 0.451 . . . . 685.46 109.898 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.15 -43.29 95.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 115.442 -0.799 . . . . 238.49 110.64 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -60.88 -43.27 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.839 -0.619 . . . . 509.15 111.276 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -43.32 98.49 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.618 0.229 . . . . 183.06 111.618 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.24 -42.28 97.95 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.881 -0.676 . . . . 63.82 112.733 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -74.7 -18.29 60.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.8 0.333 . . . . 351.91 111.505 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -75.73 -31.79 59.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.344 -0.389 . . . . 145.09 110.912 -178.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -60.76 -46.08 91.83 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.465 -0.569 . . . . 999.99 109.465 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.98 93.56 Favored Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.605 -0.725 . . . . 82.9 111.751 178.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.87 -48.27 82.59 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.428 -0.386 . . . . 392.81 111.655 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.89 -29.45 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 C-N-CA 120.929 -0.308 . . . . 455.7 111.214 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 64.2 tttm -62.41 -43.78 98.0 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.967 0.413 . . . . 756.66 110.423 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -70.22 -39.51 75.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.16 -0.473 . . . . 999.99 110.18 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.29 -38.42 91.09 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.619 0.6 . . . . 373.99 112.619 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -66.32 -19.17 65.74 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.885 -0.509 . . . . 811.35 111.431 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.11 -52.56 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 112.551 0.575 . . . . 461.27 112.551 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -111.6 -8.08 14.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.951 0.723 . . . . 575.93 112.951 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.82 -17.82 69.76 Favored Glycine 0 N--CA 1.46 0.241 0 C-N-CA 121.252 -0.499 . . . . 226.53 113.567 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -61.18 -39.37 89.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.752 0.31 . . . . 999.99 111.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -91.6 -8.22 47.92 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.688 0.625 . . . . 432.8 112.688 -179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.8 141.86 48.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.884 0.373 . . . . 844.62 111.509 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.9 p -77.59 168.44 19.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.068 -0.514 . . . . 316.62 110.375 178.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 87.0 m -60.9 -40.44 93.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.881 0.372 . . . . 291.13 110.713 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.6 -44.28 93.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.004 -0.543 . . . . 467.63 110.946 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -63.99 -41.57 97.47 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.422 -0.354 . . . . 430.34 111.232 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -62.89 -46.32 88.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.458 -0.337 . . . . 667.57 110.825 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -65.09 -40.72 94.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.118 -0.492 . . . . 527.8 110.909 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.19 78.95 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.859 -0.61 . . . . 169.13 111.499 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.01 -39.18 81.09 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.043 -0.526 . . . . 409.47 111.327 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -60.77 -40.17 91.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.701 0.286 . . . . 686.82 110.527 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.51 ' HB2' ' SD ' ' A' ' 118' ' ' MET . 61.4 t80 -66.39 -39.75 89.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.219 -0.446 . . . . 213.85 109.887 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.7 t -60.99 -43.86 96.95 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.712 -0.676 . . . . 289.44 110.025 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.68 -40.4 91.99 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.903 -0.59 . . . . 358.19 109.98 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 58' ' ' MET . 77.4 ttt-85 -60.35 -47.91 84.01 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.808 -0.633 . . . . 999.99 110.757 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.4 mmm-85 -64.59 -40.77 96.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.098 0.475 . . . . 999.99 110.793 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -62.51 -48.16 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.663 -0.698 . . . . 212.58 112.48 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.494 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 4.9 ppp? -64.36 -38.37 90.79 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.172 0.804 . . . . 262.65 113.172 -178.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.41 -39.14 71.3 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.482 -0.487 . . . . 684.75 111.78 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.6 p -73.82 -41.33 62.47 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 111.72 0.267 . . . . 450.86 111.72 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -63.76 -45.87 87.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.834 0.35 . . . . 587.54 110.427 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -62.38 -47.56 83.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.896 -0.593 . . . . 785.5 111.729 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.73 88.33 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.502 -0.317 . . . . 290.18 111.709 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -61.41 -46.87 88.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.838 0.351 . . . . 676.15 110.709 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.51 -46.7 84.85 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 824.3 110.865 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.5 mmm -52.04 -19.66 2.0 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.183 1.179 . . . . 839.61 114.183 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.0 mt -59.77 -43.59 94.27 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 118.257 0.481 . . . . 667.86 110.587 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -68.43 -45.54 72.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.03 -0.532 . . . . 999.99 111.271 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.0 mm -67.95 -41.11 84.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 115.465 -0.789 . . . . 648.32 112.787 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -59.2 -39.15 81.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.052 0.39 . . . . 555.82 112.052 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.83 -42.28 97.42 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 121.042 -0.263 . . . . 912.86 110.955 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.29 -42.06 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.528 -0.306 . . . . 999.99 111.64 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.67 -47.99 88.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.53 -0.305 . . . . 322.08 111.291 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.31 -40.32 97.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.219 -0.446 . . . . 443.19 111.504 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.31 -40.74 96.54 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.495 -0.32 . . . . 427.97 111.51 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.26 -40.28 77.92 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.817 0.341 . . . . 552.67 111.279 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.05 -8.48 79.75 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.978 -0.63 . . . . 282.78 112.776 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.6 mmt180 -74.57 145.63 43.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.61 0.243 . . . . 999.99 111.063 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 79.8 p -72.14 138.12 81.77 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.436 -0.347 . . . . 423.41 110.845 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 36.1 Cg_exo -61.51 135.36 56.62 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.537 2.158 . . . . 262.13 112.842 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.2 p -104.07 150.58 7.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.467 -0.333 . . . . 322.52 110.235 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.93 -42.07 95.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 111.974 0.361 . . . . 195.73 111.974 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.23 -43.13 97.42 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 120.906 -0.664 . . . . 116.64 113.546 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.89 -43.02 97.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.03 0.443 . . . . 397.23 110.435 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -64.42 -41.12 96.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.545 -0.752 . . . . 273.3 111.774 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.5 p -67.91 -36.19 79.76 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 121.011 -0.276 . . . . 391.43 111.306 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -62.61 -45.99 90.34 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.223 0.535 . . . . 999.99 109.639 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.72 -39.8 91.54 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.42 -0.809 . . . . 292.18 110.53 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.67 -39.71 97.78 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.633 -0.712 . . . . 65.97 112.771 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.71 94.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.651 0.262 . . . . 184.99 110.971 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -65.54 -40.65 93.12 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.144 0.497 . . . . 381.14 110.522 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.2 mm -65.52 -41.79 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.461 -0.791 . . . . 354.06 111.21 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.41 -16.96 61.32 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.899 -0.592 . . . . 88.8 113.707 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -79.78 -13.92 59.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 117.034 0.417 . . . . 999.99 111.362 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -108.58 119.81 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.772 0.32 . . . . 999.99 110.433 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.2 pt -129.82 156.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 458.46 111.483 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -136.21 21.62 3.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.344 0.592 . . . . 388.05 109.974 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.5 mtp -64.54 -39.48 93.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.324 -0.853 . . . . 538.07 112.23 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.98 -40.88 97.11 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.246 0.461 . . . . 282.7 112.246 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -78.5 -21.6 48.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.594 -0.275 . . . . 999.99 111.687 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.46 -46.76 87.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.474 -0.33 . . . . 504.74 111.013 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -62.0 -39.44 92.24 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.697 0.284 . . . . 999.99 110.902 179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -62.59 -42.72 99.73 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.112 -0.495 . . . . 558.87 110.23 179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.23 -40.24 95.47 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.802 -0.635 . . . . 412.73 111.092 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.55 -42.12 99.34 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.355 -0.384 . . . . 665.66 110.835 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.66 -44.0 97.37 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.279 -0.419 . . . . 999.99 110.976 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.89 -39.92 82.85 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.032 -0.531 . . . . 746.24 111.935 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.17 -2.23 56.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.527 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.2 t30 56.66 43.71 24.99 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 123.64 0.588 . . . . 848.93 111.299 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 78.9 mtm -103.85 111.16 23.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.368 . . . . 999.99 111.371 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 72.3 mt -94.67 118.92 66.79 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 586.78 109.996 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.83 118.88 5.77 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.159 1.906 . . . . 310.73 112.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.75 142.88 28.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 866.09 110.623 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -67.36 125.78 27.18 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.721 0.296 . . . . 999.99 110.906 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.2 mt -99.53 144.7 28.78 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.269 -0.423 . . . . 579.24 110.87 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.25 -18.89 50.72 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.667 2.245 . . . . 684.25 112.056 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -62.61 -26.67 68.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.475 -0.784 . . . . 662.15 111.358 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' MET . . . . . 0.51 ' SD ' ' HB2' ' A' ' 52' ' ' PHE . 93.9 mmm -59.88 -38.92 83.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.256 -0.429 . . . . 999.99 111.529 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.88 -40.87 94.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.573 -0.285 . . . . 675.31 110.73 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -65.35 -40.98 94.3 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.429 -0.35 . . . . 900.95 111.181 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 28.6 mm -61.91 -45.02 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.384 -0.371 . . . . 500.83 111.08 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.12 -39.69 95.43 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.024 0.379 . . . . 834.99 112.024 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -70.19 -33.18 71.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.7 mtm -88.06 132.93 34.1 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.535 0.569 . . . . 599.62 112.535 -178.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.509 ' O ' HG22 ' A' ' 129' ' ' VAL . 40.9 mmt180 -53.77 145.54 30.68 Favored Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.586 -0.734 . . . . 999.99 110.874 178.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.61 -30.06 90.97 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.671 2.247 . . . . 214.74 112.884 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.73 -36.03 81.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.233 -0.439 . . . . 248.66 111.234 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -91.98 0.48 57.47 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.552 0.575 . . . . 360.37 112.552 -178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 125' ' ' ARG . 66.3 t -83.13 116.6 65.15 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 334.76 110.964 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.56 156.34 49.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.821 2.348 . . . . 351.83 112.696 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 m -129.61 159.93 41.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.13 -0.486 . . . . 410.42 110.564 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -118.12 136.04 53.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.976 0.417 . . . . 999.99 111.521 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.3 165.64 18.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 551.94 110.349 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 3.4 mtt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.158 -0.925 . . . . 965.93 111.082 -179.285 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.0 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.815 0.341 . . . . 521.04 110.809 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -90.2 120.39 69.17 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 999.99 110.341 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.28 147.73 53.85 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.661 2.241 . . . . 546.56 112.906 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -157.16 -25.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.047 -0.524 . . . . 999.99 111.579 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -87.19 -12.63 46.3 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.288 0.477 . . . . 999.99 112.288 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.63 139.25 54.09 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.099 0.476 . . . . 999.99 112.036 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -100.52 123.57 44.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.771 -0.65 . . . . 280.85 110.008 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.45 -38.82 88.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.466 . . . . 999.99 111.282 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.77 86.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.404 -0.362 . . . . 200.79 111.562 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -68.51 -32.7 72.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 518.33 110.061 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -64.47 -38.62 91.65 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.8 -0.637 . . . . 524.44 110.018 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.71 -45.12 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 115.663 -0.699 . . . . 407.88 110.724 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.11 94.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 136.03 110.68 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.81 -38.59 89.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.899 -0.591 . . . . 505.3 111.566 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -60.61 -38.19 83.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.207 -0.452 . . . . 703.51 111.695 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.95 -43.6 99.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 324.41 110.43 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.76 -41.48 97.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.208 -0.451 . . . . 685.46 110.767 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.653 HG23 ' SD ' ' A' ' 58' ' ' MET . 94.6 mt -64.41 -43.54 97.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.876 -0.602 . . . . 238.49 110.88 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.32 -40.81 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.726 -0.67 . . . . 509.15 111.64 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.85 -43.32 94.69 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.631 0.234 . . . . 183.06 111.631 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.41 -42.62 97.56 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.677 -0.773 . . . . 63.82 112.537 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -72.41 -19.91 61.52 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 111.97 0.359 . . . . 351.91 111.97 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -31.96 58.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.612 -0.267 . . . . 145.09 111.263 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 41.0 mmt180 -61.57 -42.48 98.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.894 0.378 . . . . 999.99 110.176 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.17 70.18 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.992 -0.549 . . . . 82.9 112.195 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -60.71 -46.27 91.03 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.341 0.497 . . . . 392.81 112.341 -178.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.1 m -68.72 -26.68 33.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 112.37 0.507 . . . . 455.7 112.37 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 48.5 mmtm -63.6 -43.12 97.84 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.711 0.291 . . . . 756.66 111.072 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -81.14 -28.06 35.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.732 0.301 . . . . 999.99 111.128 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.84 -43.87 97.7 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.851 -0.613 . . . . 373.99 111.537 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -70.89 -20.87 62.46 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.822 0.304 . . . . 811.35 111.822 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 33' ' ' LYS . 89.8 t -87.59 -49.75 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.498 0.555 . . . . 461.27 112.498 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.47 8.75 41.93 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.449 0.537 . . . . 575.93 112.449 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.86 -38.9 96.08 Favored Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.333 -0.461 . . . . 226.53 113.719 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ptm180 -64.43 -23.65 67.36 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.493 0.553 . . . . 999.99 112.493 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.5 p -112.36 1.99 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.085 0.402 . . . . 432.8 112.085 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.0 tp -72.52 124.4 25.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.348 . . . . 844.62 111.21 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.6 m -77.93 156.36 30.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 316.62 110.858 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.4 m -61.08 -42.84 99.24 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.376 -0.375 . . . . 291.13 111.013 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 66.7 t -66.09 -42.07 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 116.166 -0.47 . . . . 467.63 110.597 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -62.98 -40.52 97.98 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.066 -0.516 . . . . 430.34 111.222 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.76 -47.71 85.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.43 -0.35 . . . . 667.57 110.995 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.24 -40.8 90.48 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.879 0.371 . . . . 527.8 110.953 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.63 93.91 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.796 -0.638 . . . . 169.13 111.881 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.3 -39.54 83.34 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.225 -0.443 . . . . 409.47 112.12 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -62.75 -43.4 98.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.884 -0.326 . . . . 686.82 110.232 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.62 -48.23 80.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.956 -0.565 . . . . 213.85 110.526 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.76 -42.19 93.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-N 115.52 -0.764 . . . . 289.44 111.408 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -58.89 -45.77 89.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.688 -0.233 . . . . 358.19 111.456 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 89.0 mtm180 -65.1 -42.13 94.33 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.943 -0.303 . . . . 999.99 111.211 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.97 -40.94 95.75 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.214 0.531 . . . . 999.99 110.57 178.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -61.21 -46.3 91.02 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.295 -0.866 . . . . 212.58 110.415 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.653 ' SD ' HG23 ' A' ' 23' ' ' ILE . 42.3 ttp -60.43 -40.07 89.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.617 -0.719 . . . . 262.65 110.998 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 76.6 mt-30 -61.99 -39.79 93.44 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 112.584 0.587 . . . . 684.75 112.584 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 74.1 p -65.51 -41.74 92.84 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.681 -0.408 . . . . 450.86 111.584 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 77.9 m-70 -71.06 -40.14 71.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.859 0.362 . . . . 587.54 110.775 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . 0.452 ' O ' ' HG2' ' A' ' 66' ' ' MET . 69.3 t-105 -62.12 -46.02 90.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.882 -0.599 . . . . 785.5 110.944 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -39.91 83.56 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.22 -0.445 . . . . 290.18 111.567 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -60.6 -45.4 94.13 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.269 -0.423 . . . . 676.15 111.005 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 57.1 m-85 -68.45 -39.29 81.52 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.269 -0.423 . . . . 824.3 111.199 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 62' ' ' TRP . 92.9 mmm -55.24 -41.17 71.76 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.413 0.523 . . . . 839.61 112.413 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.72 -47.71 84.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.826 0.346 . . . . 667.86 110.473 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.2 t90 -64.96 -45.94 83.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.071 -0.513 . . . . 999.99 110.828 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.6 -46.82 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.734 -0.666 . . . . 648.32 111.89 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -61.86 -40.97 97.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.831 -0.168 . . . . 555.82 111.435 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -62.45 -45.88 91.06 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.442 -0.345 . . . . 912.86 110.657 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -62.11 -46.55 88.53 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.019 -0.537 . . . . 999.99 111.075 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.93 -44.25 99.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.1 -0.5 . . . . 322.08 111.118 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -60.43 -44.18 96.05 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.344 -0.389 . . . . 443.19 111.222 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.48 97.17 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.492 -0.322 . . . . 427.97 111.476 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.01 -40.34 75.31 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.364 -0.38 . . . . 552.67 111.494 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.61 -4.91 85.08 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 116.068 -0.515 . . . . 282.78 112.351 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -75.6 154.71 36.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 999.99 111.435 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.7 p -110.44 95.68 23.67 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 423.41 110.394 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.77 151.89 57.93 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.799 2.333 . . . . 262.13 113.703 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.6 m -100.79 -176.5 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.605 -0.725 . . . . 322.52 110.863 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.03 -42.24 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.384 -0.371 . . . . 195.73 111.01 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.05 96.12 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.848 -0.692 . . . . 116.64 112.814 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.52 -41.89 96.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.078 0.466 . . . . 397.23 110.348 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -67.14 -37.56 84.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.611 -0.722 . . . . 273.3 112.032 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 70.3 p -64.96 -28.54 69.59 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.376 0.51 . . . . 391.43 112.376 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.3 ttp-105 -61.85 -46.35 89.81 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.579 -0.526 . . . . 999.99 109.579 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.83 -40.08 83.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.545 -0.752 . . . . 292.18 110.393 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.78 98.22 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.605 -0.725 . . . . 65.97 112.902 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.15 -40.61 94.5 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.543 0.211 . . . . 184.99 111.097 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.76 -40.23 94.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.271 -0.422 . . . . 381.14 110.408 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.69 -43.64 98.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.854 -0.612 . . . . 354.06 110.558 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.97 -21.21 65.43 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.884 -0.598 . . . . 88.8 113.447 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 85.7 mtp180 -80.14 -17.04 53.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.892 0.346 . . . . 999.99 111.196 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -109.2 112.73 25.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 999.99 110.725 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.3 pt -130.3 156.22 42.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.877 0.37 . . . . 458.46 111.079 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -141.01 34.12 1.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.247 0.546 . . . . 388.05 110.094 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 99.2 mtp -66.77 -34.26 77.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.427 -0.806 . . . . 538.07 111.578 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.32 80.95 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.253 -0.431 . . . . 282.7 110.941 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.1 -42.0 93.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.636 -0.711 . . . . 999.99 110.59 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -58.02 -47.33 83.39 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.967 -0.56 . . . . 504.74 111.505 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -60.41 -42.9 96.95 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.625 0.25 . . . . 999.99 110.939 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.69 -45.47 78.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.292 -0.413 . . . . 558.87 110.956 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.22 -40.18 96.73 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.866 -0.606 . . . . 412.73 112.088 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.59 -49.4 77.67 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.516 -0.311 . . . . 665.66 110.705 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -63.7 -39.27 93.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.814 0.34 . . . . 999.99 111.093 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.96 -39.88 79.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.921 -0.582 . . . . 746.24 111.817 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -82.55 -11.29 58.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.896 0.332 . . . . 999.99 111.896 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 53.51 43.03 31.81 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.394 0.434 . . . . 848.93 111.79 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -118.27 121.61 40.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.746 0.308 . . . . 999.99 110.52 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.3 mt -94.66 116.42 66.37 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.421 -0.354 . . . . 586.78 110.226 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.56 136.41 71.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.651 2.234 . . . . 310.73 112.617 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -85.46 134.42 34.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 866.09 110.579 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -68.24 116.99 9.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.795 0.331 . . . . 999.99 110.551 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.9 mt -99.38 147.67 33.64 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.404 . . . . 579.24 110.772 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.03 -28.61 66.0 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.542 2.161 . . . . 684.25 112.098 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.23 -37.91 89.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.861 -0.609 . . . . 662.15 110.813 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.0 mtt -59.6 -42.05 91.69 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-N 116.049 -0.523 . . . . 999.99 110.4 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -61.81 -44.72 96.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.125 -0.489 . . . . 675.31 110.817 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.63 -45.05 88.49 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.899 -0.592 . . . . 900.95 112.462 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.412 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 17.8 tt -72.91 -25.18 21.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 120.735 0.302 . . . . 500.83 111.719 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.13 -37.99 87.24 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.97 0.414 . . . . 834.99 111.139 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -85.44 -0.7 55.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 999.99 111.785 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.412 ' SD ' ' HA ' ' A' ' 121' ' ' ILE . 99.0 mtp -90.15 125.66 35.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.606 0.241 . . . . 599.62 111.291 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 129' ' ' VAL . 99.5 mtt180 -53.19 141.48 40.63 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-N 115.982 -0.554 . . . . 999.99 111.035 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.56 -36.63 81.2 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.982 2.454 . . . . 214.74 112.715 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.6 -34.86 76.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.923 -0.58 . . . . 248.66 111.781 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.85 0.27 57.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.229 0.455 . . . . 360.37 112.229 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 125' ' ' ARG . 63.3 t -85.57 117.02 67.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.749 0.309 . . . . 334.76 110.624 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.35 155.58 55.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.573 2.182 . . . . 351.83 112.889 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.5 t -113.77 136.86 48.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 410.42 109.843 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -115.49 131.49 56.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.85 0.357 . . . . 999.99 111.317 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -81.35 152.23 27.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 551.94 110.565 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.7 mtp . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.22 -0.895 . . . . 965.93 110.667 -179.699 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.9 t . . . . . 0 C--O 1.233 0.216 0 N-CA-C 109.653 -0.499 . . . . 521.04 109.653 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 46.3 mp0 -80.21 121.33 81.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 999.99 110.77 -178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 47.8 Cg_exo -60.23 141.91 97.03 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.002 2.468 . . . . 546.56 112.709 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -74.36 143.94 44.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.511 . . . . 999.99 110.295 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -91.23 102.91 15.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.936 0.398 . . . . 999.99 110.718 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.0 mp -57.82 149.66 21.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.638 -0.71 . . . . 999.99 111.509 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -65.2 145.73 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.877 -0.416 . . . . 280.85 109.877 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.25 -45.14 91.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.615 -0.266 . . . . 999.99 111.187 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.35 88.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.5 -0.318 . . . . 200.79 111.615 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -67.89 -35.22 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 518.33 110.213 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 95.8 mt-10 -65.18 -38.9 91.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.822 -0.626 . . . . 524.44 110.161 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.1 -45.6 95.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.823 -0.626 . . . . 407.88 111.104 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.12 98.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.898 -0.592 . . . . 136.03 111.001 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.5 mt -69.05 -38.85 79.35 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.939 -0.573 . . . . 505.3 111.948 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 62.4 mtpt -60.74 -39.37 88.43 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.39 0.515 . . . . 703.51 112.39 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.81 -44.66 99.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.709 0.29 . . . . 324.41 110.841 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.96 -40.29 91.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.415 -0.357 . . . . 685.46 111.335 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.88 -45.05 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 120.918 0.39 . . . . 238.49 110.829 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.96 -42.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 115.886 -0.597 . . . . 509.15 111.323 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.32 95.72 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 121.115 -0.234 . . . . 183.06 111.138 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.72 -42.6 95.2 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.81 -0.71 . . . . 63.82 112.653 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.428 ' O ' ' HE2' ' A' ' 98' ' ' MET . 9.8 m-30 -71.61 -19.61 62.09 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.626 0.37 . . . . 351.91 111.916 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.39 -29.01 56.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.828 -0.169 . . . . 145.09 110.887 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.59 -40.56 97.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 999.99 110.56 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.21 -29.53 40.7 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.703 -0.76 . . . . 82.9 112.492 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.5 -43.13 95.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.927 0.343 . . . . 392.81 111.927 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.72 -26.09 39.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 112.388 0.514 . . . . 455.7 112.388 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.84 -43.12 99.49 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.551 0.215 . . . . 756.66 110.85 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -72.2 -35.78 69.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.061 0.457 . . . . 999.99 110.439 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.91 -38.43 90.91 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.524 -0.762 . . . . 373.99 111.555 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -68.88 -24.02 64.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.661 0.245 . . . . 811.35 111.661 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.6 t -85.75 -46.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 112.233 0.457 . . . . 461.27 112.233 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -101.29 8.51 42.4 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.421 0.526 . . . . 575.93 112.421 -178.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.48 -26.54 69.72 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 121.483 -0.389 . . . . 226.53 113.827 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -61.61 -40.2 93.97 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.772 0.286 . . . . 999.99 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.0 p -112.96 14.18 19.65 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.037 0.384 . . . . 432.8 112.037 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.4 tp -71.12 123.53 22.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.983 0.42 . . . . 844.62 111.515 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.4 m -79.59 159.98 26.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.966 -0.561 . . . . 316.62 110.865 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.7 m -60.92 -44.98 96.44 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.335 -0.393 . . . . 291.13 111.456 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.3 m -71.03 -29.44 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 112.256 0.465 . . . . 467.63 112.256 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.69 -40.08 94.77 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 121.216 -0.194 . . . . 430.34 110.987 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.475 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.9 tttp -61.38 -46.68 89.19 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.86 0.362 . . . . 667.57 110.136 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.953 -0.567 . . . . 527.8 110.649 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.54 90.52 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 115.848 -0.615 . . . . 169.13 110.755 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.05 -39.12 93.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.084 -0.507 . . . . 409.47 111.336 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.475 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 43.4 m-85 -63.18 -38.94 93.17 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 109.249 -0.648 . . . . 686.82 109.249 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -61.09 -47.57 85.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.454 -0.793 . . . . 213.85 109.678 177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.5 t -62.86 -41.94 94.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 115.991 -0.55 . . . . 289.44 110.288 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -59.43 -43.1 93.14 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.949 -0.569 . . . . 358.19 111.053 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -61.04 -46.97 88.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.824 0.345 . . . . 999.99 110.508 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -62.74 -44.57 95.86 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.974 -0.557 . . . . 999.99 110.464 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.22 -48.11 83.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.505 -0.77 . . . . 212.58 111.232 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 43.9 ttp -60.74 -45.67 93.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.202 -0.453 . . . . 262.65 111.379 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -64.82 -41.12 96.02 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.062 -0.255 . . . . 684.75 111.063 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -63.68 -45.94 87.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.374 -0.375 . . . . 450.86 110.693 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -62.55 -46.28 89.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.894 -0.594 . . . . 587.54 110.132 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -61.51 -47.76 84.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.818 -0.628 . . . . 785.5 111.304 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.498 ' O ' HD13 ' A' ' 67' ' ' LEU . . . -59.61 -43.93 93.57 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.419 0.525 . . . . 290.18 112.419 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -43.38 96.79 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.187 -0.301 . . . . 676.15 110.187 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -65.44 -44.26 87.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.185 -0.461 . . . . 824.3 110.185 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 tpt -53.53 -45.35 69.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.428 -0.805 . . . . 839.61 111.806 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 63' ' ' ALA . 7.2 mp -60.88 -40.92 94.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.657 0.243 . . . . 667.86 111.657 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -63.04 -47.2 84.04 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.398 -0.364 . . . . 999.99 111.758 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 44.8 pt -77.44 -23.05 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.259 0.466 . . . . 648.32 112.259 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -58.99 -39.24 81.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.464 -0.335 . . . . 555.82 111.414 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.99 -43.26 99.12 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.665 0.269 . . . . 912.86 110.753 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -66.0 -45.08 82.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.255 -0.429 . . . . 999.99 110.758 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 37.8 mm -62.85 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.816 -0.629 . . . . 322.08 111.327 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -62.04 -43.61 98.46 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.31 -0.404 . . . . 443.19 111.368 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.45 97.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.498 -0.319 . . . . 427.97 111.462 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.15 -40.67 78.07 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.894 0.378 . . . . 552.67 111.168 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.91 -9.77 75.29 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.053 -0.521 . . . . 282.78 112.675 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -75.26 147.79 39.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.377 . . . . 999.99 111.338 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 12.1 p -102.02 106.3 46.92 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 423.41 110.51 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.11 145.4 49.33 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.628 2.219 . . . . 262.13 113.473 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.7 m -101.66 -175.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 322.52 111.236 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.61 -40.58 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.333 -0.394 . . . . 195.73 110.81 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.619 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.09 -40.29 96.92 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.889 -0.672 . . . . 116.64 112.641 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.9 -42.66 80.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.086 0.469 . . . . 397.23 110.612 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -68.2 -35.49 78.07 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.856 -0.611 . . . . 273.3 112.236 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.619 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -59.8 -34.64 73.3 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.453 0.168 . . . . 391.43 111.453 -179.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.98 -41.16 95.67 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.062 0.458 . . . . 999.99 109.898 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.22 -39.81 78.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.494 -0.776 . . . . 292.18 110.265 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -39.52 97.69 Favored Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.421 -0.809 . . . . 65.97 112.535 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.18 92.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.596 0.236 . . . . 184.99 110.67 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -64.78 -40.43 95.24 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.102 -0.499 . . . . 381.14 110.25 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.65 -43.24 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.639 -0.71 . . . . 354.06 110.589 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.72 -22.37 64.07 Favored Glycine 0 CA--C 1.52 0.394 0 CA-C-N 115.895 -0.593 . . . . 88.8 113.429 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.5 mmt-85 -80.08 -18.56 49.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.896 0.348 . . . . 999.99 111.191 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.1 mmt85 -108.47 111.98 24.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 999.99 110.379 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 60.4 mt -124.66 126.17 71.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.844 -0.428 . . . . 458.46 109.844 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.35 32.23 5.71 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.971 -0.292 . . . . 388.05 111.633 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' PHE . 77.7 mtm -70.0 -28.73 65.74 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.556 -0.293 . . . . 538.07 111.039 179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.79 -37.96 80.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.016 -0.538 . . . . 282.7 110.777 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -59.83 -42.21 93.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.665 -0.698 . . . . 999.99 110.368 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.94 -46.78 84.53 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.821 -0.627 . . . . 504.74 111.12 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -60.12 -44.37 94.95 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.536 0.208 . . . . 999.99 110.799 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.21 -42.74 93.18 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.455 -0.339 . . . . 558.87 111.126 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.85 96.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.063 -0.517 . . . . 412.73 111.574 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.97 -46.22 90.21 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.887 -0.597 . . . . 665.66 110.852 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.73 -39.31 93.98 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.307 -0.406 . . . . 999.99 111.352 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.73 -38.91 79.41 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.196 -0.456 . . . . 746.24 111.879 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -83.09 -11.65 57.8 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.601 -0.272 . . . . 999.99 111.385 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 54.98 39.89 31.8 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.563 0.539 . . . . 848.93 111.615 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.2 ttp -107.72 124.0 49.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.337 -0.392 . . . . 999.99 110.874 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.3 mt -94.11 117.12 67.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.378 -0.374 . . . . 586.78 110.373 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -59.78 142.02 97.89 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.821 2.347 . . . . 310.73 112.421 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -84.79 119.49 25.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 866.09 110.403 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -70.07 116.5 10.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.058 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.701 ' O ' ' HG2' ' A' ' 118' ' ' MET . 3.4 mm? -99.04 129.96 28.45 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.488 . . . . 579.24 111.243 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -58.5 -31.9 95.3 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.733 2.289 . . . . 684.25 112.565 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -61.22 -40.89 95.68 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.931 0.715 . . . . 662.15 112.931 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' MET . . . . . 0.701 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 24.8 ptt? -55.39 -22.46 19.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.551 0.575 . . . . 999.99 112.551 -178.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.13 -39.09 88.7 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.144 0.497 . . . . 675.31 110.337 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -67.75 -37.23 81.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.755 -0.657 . . . . 900.95 111.147 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.2 mt -60.34 -46.25 95.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.761 0.652 . . . . 500.83 112.761 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -80.46 -9.84 59.75 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.208 -0.597 . . . . 834.99 111.232 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -87.98 -32.77 18.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.822 0.344 . . . . 999.99 110.923 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 ptp -77.7 148.32 35.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.032 0.444 . . . . 599.62 111.855 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 42.5 ttm105 -51.96 128.69 37.96 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-N 115.371 -0.831 . . . . 999.99 111.572 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.19 -35.32 90.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.096 2.531 . . . . 214.74 112.895 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.13 -24.14 67.76 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.119 -0.491 . . . . 248.66 112.117 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.73 -0.93 57.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.622 -0.263 . . . . 360.37 111.563 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.2 t -88.0 119.23 70.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.688 0.28 . . . . 334.76 110.829 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.17 156.98 58.52 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.826 2.351 . . . . 351.83 112.749 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.9 t -118.73 137.45 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.057 -0.52 . . . . 410.42 110.53 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -114.57 129.79 56.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.505 -0.316 . . . . 999.99 110.425 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -82.69 75.28 9.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.938 0.399 . . . . 551.94 110.91 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.5 mtm . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.25 -0.881 . . . . 965.93 110.995 179.767 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.751 0.31 . . . . 521.04 110.659 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -81.15 156.97 71.52 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.447 . . . . 999.99 110.829 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.78 139.76 90.04 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.639 2.226 . . . . 546.56 111.933 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -121.86 -51.26 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.868 0.322 . . . . 999.99 111.868 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -101.02 3.22 41.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.81 0.3 . . . . 999.99 111.81 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.97 113.62 1.97 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.826 0.346 . . . . 999.99 111.492 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -114.24 152.07 31.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 280.85 110.969 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.34 -41.72 97.51 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.218 -0.446 . . . . 999.99 110.557 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.56 -38.79 82.06 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.932 -0.576 . . . . 200.79 111.405 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -63.08 -37.98 89.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 518.33 109.876 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.21 -44.07 96.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.855 -0.611 . . . . 524.44 110.271 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.89 -45.81 97.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.609 -0.723 . . . . 407.88 111.242 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.19 90.63 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.058 -0.519 . . . . 136.03 111.164 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.1 mt -62.02 -42.37 99.09 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.35 -0.386 . . . . 505.3 110.715 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.407 ' O ' HG12 ' A' ' 24' ' ' ILE . 31.7 mmmt -61.98 -39.81 93.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.383 -0.371 . . . . 703.51 111.353 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 76.4 t -64.0 -46.64 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.669 -0.241 . . . . 324.41 110.994 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -68.41 -42.72 78.56 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.907 0.384 . . . . 685.46 111.034 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.41 ' O ' ' HD1' ' A' ' 27' ' ' PHE . 83.6 mt -63.8 -46.73 93.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.728 -0.669 . . . . 238.49 112.432 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.407 HG12 ' O ' ' A' ' 20' ' ' LYS . 30.1 mm -61.02 -45.98 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 121.044 -0.263 . . . . 509.15 111.058 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.51 92.28 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.768 0.285 . . . . 183.06 111.768 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.52 -45.25 90.78 Favored Glycine 0 C--N 1.335 0.521 0 C-N-CA 120.938 -0.649 . . . . 63.82 113.683 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.41 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 46.6 m-85 -73.2 -20.79 60.8 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.017 0.377 . . . . 351.91 112.017 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.51 ' O ' HG22 ' A' ' 32' ' ' VAL . 35.0 t70 -75.9 -38.14 58.07 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.827 -0.17 . . . . 145.09 111.17 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 tpp85 -60.56 -45.82 92.49 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.833 -0.432 . . . . 999.99 109.833 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.435 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.47 -40.09 98.2 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.761 -0.654 . . . . 82.9 112.387 178.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.33 -39.46 94.61 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.573 0.225 . . . . 392.81 111.122 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 28' ' ' ASP . 57.6 t -59.8 -40.09 81.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.137 -0.483 . . . . 455.7 111.76 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.17 -41.6 93.17 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 111.653 0.242 . . . . 756.66 111.653 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.435 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 7.3 m-90 -80.74 -36.95 31.37 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.687 0.28 . . . . 999.99 111.49 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.8 mt -64.74 -38.37 90.75 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.536 0.569 . . . . 373.99 112.536 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -64.13 -18.82 64.8 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.449 0.537 . . . . 811.35 112.449 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.1 t -84.71 -42.92 17.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.741 0.305 . . . . 461.27 111.699 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -104.25 11.96 34.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.753 0.311 . . . . 575.93 111.555 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.18 -20.14 68.87 Favored Glycine 0 CA--C 1.517 0.195 0 CA-C-N 116.049 -0.523 . . . . 226.53 114.359 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -61.31 -40.84 95.67 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.038 0.419 . . . . 999.99 111.662 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.6 p -113.4 9.99 18.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.911 0.338 . . . . 432.8 111.911 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.6 tp -71.75 123.35 22.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.986 0.422 . . . . 844.62 111.946 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.5 m -79.77 157.93 26.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 316.62 110.454 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 94.2 m -60.93 -44.36 97.34 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.803 0.335 . . . . 291.13 111.183 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.39 -31.75 52.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.263 -0.426 . . . . 467.63 112.068 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.92 -41.97 90.7 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.867 0.365 . . . . 430.34 110.282 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.7 tttp -62.86 -46.42 87.95 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.808 -0.633 . . . . 667.57 110.229 178.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' O ' ' HE2' ' A' ' 118' ' ' MET . 55.2 mtpt -63.18 -40.72 98.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.395 -0.821 . . . . 527.8 111.252 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.37 95.71 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.169 -0.469 . . . . 169.13 111.626 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.444 ' HA ' HD22 ' A' ' 50' ' ' LEU . 88.2 mt -64.25 -39.11 93.28 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.29 -0.414 . . . . 409.47 112.0 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.495 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 36.3 m-85 -63.5 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.829 -0.434 . . . . 686.82 109.829 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -62.27 -47.14 85.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.622 -0.717 . . . . 213.85 111.341 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.25 -26.81 23.04 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 C-N-CA 120.5 -0.48 . . . . 289.44 111.366 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.12 -44.36 96.81 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.859 0.362 . . . . 358.19 110.307 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtm-85 -64.99 -38.64 91.62 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.875 -0.602 . . . . 999.99 110.975 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -60.24 -45.39 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.33 -0.395 . . . . 999.99 109.973 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -59.63 -47.7 84.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.893 -0.594 . . . . 212.58 110.437 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -59.99 -46.18 90.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 262.65 111.263 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -62.82 -40.96 99.01 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 112.034 0.383 . . . . 684.75 112.034 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.9 p -69.91 -39.34 76.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.84 -0.344 . . . . 450.86 111.476 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -71.98 -42.82 66.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.901 0.381 . . . . 587.54 110.79 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -62.59 -40.17 96.04 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.83 -0.623 . . . . 785.5 111.961 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.84 -40.81 80.95 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.096 0.406 . . . . 290.18 112.096 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -63.66 -42.24 98.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.691 0.281 . . . . 676.15 111.03 179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.06 -39.96 68.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.401 -0.363 . . . . 824.3 111.344 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 tpt -52.53 -43.09 64.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.81 -0.632 . . . . 839.61 112.16 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.67 -43.54 98.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.675 -0.239 . . . . 667.86 111.281 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.22 -40.03 78.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.942 0.401 . . . . 999.99 110.855 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.14 -44.97 99.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.759 -0.655 . . . . 648.32 110.64 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.03 -41.81 97.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.017 -0.538 . . . . 555.82 110.925 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -62.56 -43.14 99.55 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.616 -0.265 . . . . 912.86 110.873 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.41 -47.46 81.89 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.164 -0.471 . . . . 999.99 111.136 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.41 -45.75 97.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.186 -0.461 . . . . 322.08 111.076 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.203 -0.453 . . . . 443.19 111.449 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.46 97.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.375 -0.375 . . . . 427.97 111.716 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.16 -40.99 77.84 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.909 0.385 . . . . 552.67 111.247 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.72 -8.89 78.19 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 121.155 -0.545 . . . . 282.78 112.733 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -75.2 145.1 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.74 0.305 . . . . 999.99 111.354 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 34.8 p -83.88 120.54 75.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.441 -0.345 . . . . 423.41 110.67 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.98 146.52 37.32 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.498 2.132 . . . . 262.13 112.987 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 m -102.57 169.84 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 322.52 111.158 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.64 -40.48 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.204 -0.453 . . . . 195.73 111.205 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.43 -39.07 94.39 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.152 -0.547 . . . . 116.64 112.94 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.77 -40.53 95.48 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.826 0.346 . . . . 397.23 110.527 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -67.92 -40.09 83.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.085 -0.507 . . . . 273.3 111.563 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.3 p -68.26 -34.69 76.65 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.004 -0.278 . . . . 391.43 111.075 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -62.77 -45.2 93.79 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.958 0.408 . . . . 999.99 109.985 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.16 -41.33 97.19 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.702 -0.681 . . . . 292.18 110.785 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.95 -40.27 99.08 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.992 -0.549 . . . . 65.97 112.432 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.46 92.78 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.671 0.272 . . . . 184.99 111.247 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.01 -39.95 90.7 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.099 0.476 . . . . 381.14 110.734 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.76 -40.05 86.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.545 -0.752 . . . . 354.06 110.943 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.14 57.66 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.875 -0.602 . . . . 88.8 114.162 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -78.25 -22.35 48.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.178 0.489 . . . . 999.99 111.441 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -109.01 115.43 30.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.899 0.381 . . . . 999.99 110.842 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.0 pt -131.85 153.04 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 120.876 0.37 . . . . 458.46 111.225 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.8 p-10 -116.24 20.73 14.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 388.05 110.703 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.96 -39.36 91.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.556 . . . . 538.07 111.627 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.26 96.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.895 0.379 . . . . 282.7 110.634 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -69.08 -40.14 78.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.738 -0.665 . . . . 999.99 110.53 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.71 -49.08 79.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.005 -0.543 . . . . 504.74 110.73 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -60.52 -48.3 82.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.067 -0.515 . . . . 999.99 110.869 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.21 -45.91 91.24 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.139 -0.482 . . . . 558.87 111.501 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.9 -40.79 98.63 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.551 -0.295 . . . . 412.73 111.695 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 110' ' ' MET . 61.1 tp -61.35 -47.39 86.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.294 -0.412 . . . . 665.66 110.573 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -66.71 -39.03 87.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.197 -0.456 . . . . 999.99 111.017 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.05 -40.63 81.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.92 -0.582 . . . . 746.24 111.953 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -82.52 -11.38 58.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.626 -0.261 . . . . 999.99 111.466 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.8 t30 55.01 44.28 28.46 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.189 0.518 . . . . 848.93 111.699 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' MET . . . . . 0.42 ' O ' HD13 ' A' ' 105' ' ' LEU . 26.5 mmt -117.45 128.74 55.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 999.99 110.534 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . 0.415 HG23 HD13 ' A' ' 111' ' ' ILE . 50.6 mm -94.63 116.6 66.56 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.534 -0.303 . . . . 586.78 110.67 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.53 154.86 50.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.467 2.112 . . . . 310.73 112.312 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -81.7 121.43 26.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.774 0.321 . . . . 866.09 110.231 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -69.26 138.38 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.041 -0.527 . . . . 999.99 110.846 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 83.4 mt -99.24 112.72 63.82 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 579.24 112.011 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -60.45 -27.58 85.13 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.119 2.546 . . . . 684.25 111.996 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -60.57 -26.43 66.93 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.119 -0.946 . . . . 662.15 111.556 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' MET . . . . . 0.419 ' HE2' ' O ' ' A' ' 48' ' ' LYS . 30.8 mmm -57.18 -28.24 62.62 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.443 0.534 . . . . 999.99 112.443 -179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -60.2 -44.24 95.27 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.024 -0.361 . . . . 675.31 110.024 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -67.43 -39.19 85.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.064 -0.516 . . . . 900.95 110.821 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.409 HD12 HG23 ' A' ' 121' ' ' ILE . 34.9 mm -61.51 -45.05 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.164 -0.471 . . . . 500.83 110.865 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -61.13 -40.11 92.54 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.97 -0.559 . . . . 834.99 111.288 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -67.37 -33.27 74.87 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.202 0.445 . . . . 999.99 112.202 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.4 mtp -76.76 129.74 36.72 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.301 0.482 . . . . 599.62 112.301 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -54.04 147.82 23.84 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 115.537 -0.756 . . . . 999.99 111.441 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.1 -28.2 86.51 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.758 2.306 . . . . 214.74 112.522 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.48 -31.32 72.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.168 -0.469 . . . . 248.66 111.291 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.21 -0.06 57.62 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.073 -0.512 . . . . 360.37 111.696 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.2 t -90.53 115.38 64.03 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.656 0.265 . . . . 334.76 110.636 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.9 159.46 48.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.786 2.324 . . . . 351.83 112.773 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -116.59 136.81 52.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 410.42 109.539 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -113.27 120.83 42.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.926 0.394 . . . . 999.99 111.358 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -84.17 163.37 19.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.825 -0.625 . . . . 551.94 110.23 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.2 mmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.282 -0.866 . . . . 965.93 110.685 -179.502 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.6 t . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.684 0.278 . . . . 521.04 110.7 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -82.27 124.95 77.88 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 999.99 110.363 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.06 141.16 43.3 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.439 2.093 . . . . 546.56 112.835 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -132.04 148.6 52.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.002 -0.545 . . . . 999.99 110.467 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 56.33 43.14 26.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.607 0.567 . . . . 999.99 112.052 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.52 137.02 49.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.268 -0.424 . . . . 999.99 111.251 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -88.04 104.31 16.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.404 . . . . 280.85 110.316 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -63.33 -39.16 93.77 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.775 -0.648 . . . . 999.99 112.166 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -41.31 90.72 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.738 0.304 . . . . 200.79 111.741 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -67.71 -33.91 75.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 518.33 109.932 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 96.5 mt-10 -64.98 -40.45 94.99 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.737 -0.665 . . . . 524.44 110.27 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.58 -46.44 96.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 115.955 -0.566 . . . . 407.88 111.037 179.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.45 92.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.927 -0.579 . . . . 136.03 110.322 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.2 tp -64.11 -39.27 93.67 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.409 -0.814 . . . . 505.3 110.898 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 98.4 mttt -59.22 -37.08 76.63 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.907 -0.588 . . . . 703.51 111.671 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.51 -43.76 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 324.41 110.461 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -68.56 -39.69 80.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.892 0.377 . . . . 685.46 110.554 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.78 -47.4 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.689 -0.687 . . . . 238.49 112.84 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.0 pt -63.33 -37.39 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 N-CA-C 112.577 0.584 . . . . 509.15 112.577 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.81 91.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.637 0.256 . . . . 183.06 111.441 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.43 -41.91 65.89 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.023 -0.608 . . . . 63.82 113.2 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -73.01 -19.02 61.28 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.731 0.641 . . . . 351.91 112.731 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -75.01 -36.49 61.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.072 -0.251 . . . . 145.09 111.045 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -63.65 -40.53 97.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.929 0.395 . . . . 999.99 110.191 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.65 -39.36 97.46 Favored Glycine 0 C--N 1.333 0.384 0 CA-C-N 115.701 -0.681 . . . . 82.9 112.177 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.414 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 83.7 mt -62.63 -40.67 97.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.717 0.294 . . . . 392.81 110.608 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.7 t -61.38 -42.79 95.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.789 -0.641 . . . . 455.7 111.36 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 68.5 mttm -61.38 -41.51 97.23 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.532 -0.304 . . . . 756.66 111.418 -179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -70.62 -43.9 68.34 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.287 0.565 . . . . 999.99 110.211 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 97.2 mt -63.27 -38.97 93.23 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.341 -0.845 . . . . 373.99 113.163 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -63.9 -18.65 64.42 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.508 0.558 . . . . 811.35 112.508 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -84.92 -44.99 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 112.031 0.382 . . . . 461.27 112.031 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -103.28 9.57 38.01 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.773 0.321 . . . . 575.93 111.775 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.99 -21.29 63.45 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.559 0.584 . . . . 226.53 114.559 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.49 -41.19 96.89 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 117.187 0.494 . . . . 999.99 111.696 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.7 p -113.69 10.23 17.92 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.911 0.337 . . . . 432.8 111.911 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.8 tp -71.64 124.58 25.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.126 0.417 . . . . 844.62 112.126 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.2 m -78.98 158.67 27.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 316.62 110.305 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -60.91 -44.78 96.68 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.664 0.269 . . . . 291.13 111.575 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.08 -31.76 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 N-CA-C 112.075 0.398 . . . . 467.63 112.075 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -64.9 -40.15 94.64 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.536 0.208 . . . . 430.34 110.82 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.439 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 29.3 ttpp -61.37 -45.86 92.61 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.26 -0.427 . . . . 667.57 110.43 179.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -65.22 -39.66 93.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.045 -0.525 . . . . 527.8 110.674 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.74 92.65 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.877 -0.602 . . . . 169.13 111.295 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 50' ' ' LEU . 86.5 mt -63.42 -38.58 91.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.095 -0.502 . . . . 409.47 111.785 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.439 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 23.3 m-85 -61.66 -38.96 89.69 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.505 -0.554 . . . . 686.82 109.505 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -65.29 -41.75 93.82 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.674 -0.694 . . . . 213.85 109.74 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.6 t -62.43 -40.4 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.041 -0.527 . . . . 289.44 110.339 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -58.86 -39.42 81.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.561 -0.745 . . . . 358.19 110.963 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.7 mmm-85 -61.77 -42.23 98.72 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.722 -0.217 . . . . 999.99 110.583 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.35 -40.8 96.58 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.06 0.457 . . . . 999.99 110.116 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -61.65 -48.18 82.04 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.608 -0.724 . . . . 212.58 110.93 178.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -60.52 -46.84 88.67 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.828 -0.624 . . . . 262.65 112.023 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -65.65 -33.54 76.12 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 120.733 -0.387 . . . . 684.75 111.145 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.0 m -66.1 -45.99 79.22 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.194 0.521 . . . . 450.86 110.214 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -64.29 -45.29 88.67 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.635 -0.711 . . . . 587.54 110.445 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -62.73 -43.53 98.56 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.666 -0.697 . . . . 785.5 111.845 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.99 78.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.125 0.417 . . . . 290.18 112.125 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -60.07 -49.75 76.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 676.15 110.889 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.422 ' O ' HG12 ' A' ' 69' ' ' ILE . 54.4 m-85 -72.17 -37.76 69.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.328 -0.396 . . . . 824.3 111.658 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -53.0 -46.21 68.22 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.433 0.458 . . . . 839.61 110.788 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.44 -44.44 96.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.989 -0.551 . . . . 667.86 111.276 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -66.91 -40.69 87.76 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.582 0.586 . . . . 999.99 112.582 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.3 pt -79.21 -25.51 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 N-CA-C 112.203 0.446 . . . . 648.32 112.203 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.52 -41.89 95.32 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.529 0.204 . . . . 555.82 110.813 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.6 -47.15 86.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.335 -0.393 . . . . 912.86 110.618 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -63.38 -46.75 85.02 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.928 -0.578 . . . . 999.99 111.286 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.15 -44.99 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.146 -0.479 . . . . 322.08 111.162 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -61.24 -43.85 98.21 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.314 -0.403 . . . . 443.19 111.269 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.02 -40.35 97.47 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.517 -0.311 . . . . 427.97 111.402 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.13 -39.57 82.69 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.295 -0.411 . . . . 552.67 111.253 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.65 -0.04 89.22 Favored Glycine 0 C--N 1.332 0.317 0 CA-C-N 116.0 -0.546 . . . . 282.78 112.508 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.2 mmp_? -75.16 149.7 38.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.907 0.384 . . . . 999.99 111.227 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.4 p -106.83 101.07 35.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 423.41 110.807 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -59.88 142.52 98.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.132 2.555 . . . . 262.13 112.931 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.429 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 15.7 m -100.26 -176.36 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.988 -0.551 . . . . 322.52 110.971 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.7 t -59.64 -43.46 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.39 -0.368 . . . . 195.73 111.082 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.11 -39.55 95.96 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.894 -0.669 . . . . 116.64 112.52 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -62.16 -41.28 98.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.896 0.379 . . . . 397.23 110.72 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 47.6 m-85 -68.38 -39.95 81.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.968 -0.56 . . . . 273.3 111.416 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.4 p -67.34 -36.0 80.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 111.633 0.234 . . . . 391.43 111.633 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.61 -47.16 84.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.215 0.531 . . . . 999.99 110.095 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 tp -67.99 -42.09 81.29 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.575 -0.739 . . . . 292.18 110.514 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.32 -39.39 97.16 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.763 -0.653 . . . . 65.97 113.042 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -60.77 -40.76 93.73 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.756 0.312 . . . . 184.99 110.869 179.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.4 -39.44 93.86 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.097 -0.501 . . . . 381.14 110.352 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.4 mm -63.9 -42.09 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.628 -0.715 . . . . 354.06 110.758 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -71.17 -9.35 67.11 Favored Glycine 0 CA--C 1.521 0.466 0 CA-C-N 115.842 -0.617 . . . . 88.8 113.995 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.3 mmm180 -77.72 -25.96 49.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.314 0.557 . . . . 999.99 111.331 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -108.53 112.15 24.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.891 0.376 . . . . 999.99 110.681 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 79.0 mt -125.68 125.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 458.46 110.591 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -137.44 65.67 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.883 0.373 . . . . 388.05 110.581 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.3 ptm -72.38 -21.12 61.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.987 -0.552 . . . . 538.07 110.755 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.27 89.82 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.886 -0.597 . . . . 282.7 110.681 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.22 -48.35 82.1 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.796 -0.638 . . . . 999.99 111.143 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -62.81 -44.06 97.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.354 -0.384 . . . . 504.74 110.301 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -60.67 -47.67 85.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.911 -0.586 . . . . 999.99 110.539 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.46 -41.68 97.59 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.762 -0.654 . . . . 558.87 111.062 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.07 98.08 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.387 -0.37 . . . . 412.73 111.209 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.95 -41.09 97.69 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.46 -0.336 . . . . 665.66 110.598 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -63.0 -44.53 95.77 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.807 -0.633 . . . . 999.99 111.158 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.78 -39.79 82.11 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.075 -0.512 . . . . 746.24 112.155 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -91.37 0.19 57.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.562 -0.29 . . . . 999.99 111.697 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 57.5 36.2 26.68 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.022 0.439 . . . . 848.93 111.21 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 16.7 mmt -100.19 79.39 2.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.167 0.508 . . . . 999.99 111.088 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 71.6 mt -93.65 120.67 65.96 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.896 -0.593 . . . . 586.78 110.17 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.91 149.93 66.63 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.366 2.044 . . . . 310.73 112.504 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -80.11 129.67 34.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 866.09 110.63 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -69.87 86.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.97 -0.559 . . . . 999.99 111.199 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.97 149.67 35.96 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 579.24 111.297 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.18 -25.22 65.27 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.737 2.292 . . . . 684.25 112.322 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -60.63 -45.14 95.17 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.04 -0.527 . . . . 662.15 111.338 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 96.8 mtp -59.99 -40.68 90.01 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.249 -0.432 . . . . 999.99 109.885 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.28 -40.43 96.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.777 -0.647 . . . . 675.31 110.374 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -62.97 -42.13 99.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.859 -0.61 . . . . 900.95 111.179 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.29 -44.49 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.68 0.276 . . . . 500.83 110.449 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -61.25 -41.81 97.55 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.059 -0.518 . . . . 834.99 111.346 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -65.63 -33.88 76.93 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.346 -0.388 . . . . 999.99 111.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.8 mtp -72.57 140.68 48.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 599.62 111.714 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.41 ' O ' HG21 ' A' ' 129' ' ' VAL . 91.3 mtm180 -52.38 141.3 33.13 Favored Pre-proline 0 C--O 1.234 0.281 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.237 178.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -60.78 -25.73 81.67 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.677 2.251 . . . . 214.74 112.548 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.16 80.57 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.029 -0.532 . . . . 248.66 111.618 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.65 -2.54 57.85 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.339 -0.391 . . . . 360.37 111.934 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.41 HG21 ' O ' ' A' ' 125' ' ' ARG . 60.9 t -93.18 116.1 65.99 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.243 -0.28 . . . . 334.76 110.243 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.21 151.03 72.22 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.44 2.094 . . . . 351.83 112.752 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.1 t -109.06 137.43 41.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.913 -0.585 . . . . 410.42 110.134 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.1 141.93 47.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.829 0.347 . . . . 999.99 110.733 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -83.39 158.83 21.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 551.94 110.81 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.348 -0.834 . . . . 965.93 111.139 -179.12 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.7 t . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.919 0.39 . . . . 521.04 111.089 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -91.52 119.98 68.38 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 999.99 110.562 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.44 139.38 34.48 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.295 1.996 . . . . 546.56 112.392 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -98.22 -11.33 22.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.963 0.411 . . . . 999.99 111.292 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -108.85 12.46 25.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.351 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.81 114.49 2.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.017 0.437 . . . . 999.99 111.602 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -114.91 126.77 55.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 280.85 110.037 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.54 -39.49 91.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.769 0.319 . . . . 999.99 110.841 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.77 87.87 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.242 -0.435 . . . . 200.79 111.412 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -68.23 -32.48 72.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.009 -0.541 . . . . 518.33 110.108 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -63.08 -41.61 99.46 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.738 -0.665 . . . . 524.44 109.961 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.12 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 115.803 -0.635 . . . . 407.88 111.033 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.16 -40.87 97.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.232 -0.44 . . . . 136.03 110.626 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.77 -43.01 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.823 -0.626 . . . . 505.3 110.312 178.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -59.72 -44.21 93.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.391 -0.822 . . . . 703.51 111.498 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.66 -42.82 97.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 324.41 111.69 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -63.9 -41.13 97.78 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.738 0.304 . . . . 685.46 111.177 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.263 -0.426 . . . . 238.49 110.582 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.59 -42.87 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 115.972 -0.558 . . . . 509.15 111.325 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.49 95.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.743 0.275 . . . . 183.06 111.743 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.98 -41.28 97.4 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 120.801 -0.714 . . . . 63.82 112.493 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.489 ' O ' HD11 ' A' ' 31' ' ' LEU . 10.6 m-30 -73.18 -19.6 61.07 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.726 0.41 . . . . 351.91 111.504 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -75.64 -34.67 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.315 . . . . 145.09 111.046 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.75 -44.23 96.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.998 0.428 . . . . 999.99 109.907 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.04 -37.59 94.14 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.533 -0.758 . . . . 82.9 112.521 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.489 HD11 ' O ' ' A' ' 27' ' ' PHE . 6.7 mp -68.83 -41.27 78.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.71 0.291 . . . . 392.81 110.403 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.9 -44.9 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.018 -0.537 . . . . 455.7 110.779 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 -40.14 95.07 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.756 0.312 . . . . 756.66 110.944 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.6 t90 -64.96 -42.0 94.99 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.315 -0.624 . . . . 999.99 109.315 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.446 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 83.6 mt -62.67 -36.68 83.65 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.332 -0.849 . . . . 373.99 111.293 179.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.13 -37.72 86.23 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.585 0.217 . . . . 811.35 111.585 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.2 t -87.01 -50.59 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 113.616 0.969 . . . . 461.27 113.616 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -99.77 -1.49 37.54 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.083 0.771 . . . . 575.93 113.083 -177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.446 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -73.51 -11.87 80.19 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 121.233 -0.508 . . . . 226.53 114.05 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.54 -41.17 96.95 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.91 0.355 . . . . 999.99 111.533 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 61.7 p -113.29 5.44 16.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.875 0.369 . . . . 432.8 111.694 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.4 tp -71.85 133.38 45.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.054 -0.521 . . . . 844.62 111.3 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -75.89 161.52 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.039 -0.528 . . . . 316.62 111.266 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.1 -44.54 94.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.998 -0.547 . . . . 291.13 111.913 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.48 -30.4 47.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.558 0.218 . . . . 467.63 111.352 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -67.04 -38.12 85.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.47 -0.332 . . . . 430.34 110.344 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -62.7 -40.41 97.04 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.074 0.464 . . . . 667.57 110.242 178.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -69.48 -33.01 72.26 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.627 -0.715 . . . . 527.8 110.784 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.33 76.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.833 -0.621 . . . . 169.13 111.639 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 50' ' ' LEU . 82.0 mt -60.49 -39.18 86.74 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.832 0.308 . . . . 409.47 111.832 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -63.55 -39.04 93.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.916 -0.402 . . . . 686.82 109.916 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -70.11 -40.72 74.72 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.758 -0.655 . . . . 213.85 110.449 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.6 t -63.59 -40.49 89.25 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 N-CA-C 109.655 -0.498 . . . . 289.44 109.655 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -59.34 -39.82 84.41 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.455 -0.793 . . . . 358.19 110.52 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 ttt-85 -60.69 -47.63 85.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.49 -0.323 . . . . 999.99 110.625 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.67 -41.26 96.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.139 0.495 . . . . 999.99 110.552 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -61.89 -47.35 85.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.46 -0.791 . . . . 212.58 110.905 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.5 ttt -59.81 -48.21 82.62 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.429 -0.805 . . . . 262.65 112.82 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -66.04 -31.3 72.1 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.149 0.425 . . . . 684.75 112.149 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.6 m -64.0 -49.72 71.33 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.882 0.372 . . . . 450.86 110.962 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.502 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 76.1 m-70 -72.56 -36.91 68.34 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.235 -0.439 . . . . 587.54 111.636 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -60.13 -45.32 93.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.939 -0.573 . . . . 785.5 111.088 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.76 90.85 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.884 0.327 . . . . 290.18 111.884 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -64.44 -42.22 96.11 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.751 0.31 . . . . 676.15 111.175 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.502 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 38.5 m-85 -70.34 -37.48 74.66 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.245 -0.434 . . . . 824.3 111.371 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.0 ttp -52.29 -46.12 65.79 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.086 -0.506 . . . . 839.61 111.722 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.02 -41.49 98.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.462 -0.335 . . . . 667.86 111.056 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -67.72 -41.59 83.24 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.067 0.46 . . . . 999.99 110.666 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.46 -45.63 97.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 115.637 -0.71 . . . . 648.32 111.223 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -61.86 -40.88 96.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.312 -0.404 . . . . 555.82 111.571 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.77 -42.29 97.82 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.699 0.285 . . . . 912.86 110.747 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.46 -46.16 87.5 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.08 -0.509 . . . . 999.99 111.098 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.64 -46.5 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 CA-C-N 116.196 -0.456 . . . . 322.08 111.111 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.14 -45.3 92.6 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.379 -0.373 . . . . 443.19 111.667 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.56 97.47 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.114 0.413 . . . . 427.97 112.114 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -76.08 -44.36 39.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.865 0.364 . . . . 552.67 111.334 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.46 -10.82 73.27 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.207 -0.521 . . . . 282.78 113.132 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -75.34 155.27 36.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.951 0.405 . . . . 999.99 111.571 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.435 ' O ' HG23 ' A' ' 79' ' ' THR . 6.9 t -93.38 116.95 67.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-N 116.158 -0.473 . . . . 423.41 110.374 178.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.27 141.9 40.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.322 2.015 . . . . 262.13 113.178 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.451 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 17.9 m -102.45 -176.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 322.52 110.976 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 75.3 t -62.68 -41.03 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.904 0.383 . . . . 195.73 110.112 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.596 ' O ' HG21 ' A' ' 86' ' ' THR . . . -60.11 -38.73 94.81 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.795 -0.638 . . . . 116.64 112.39 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -62.02 -40.98 97.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.038 0.447 . . . . 397.23 110.31 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.451 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 48.5 m-85 -69.18 -38.18 78.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.809 -0.632 . . . . 273.3 111.451 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.596 HG21 ' O ' ' A' ' 83' ' ' GLY . 0.7 OUTLIER -64.47 -36.12 83.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 121.074 -0.25 . . . . 391.43 110.812 -179.736 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.77 -41.25 92.28 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.027 0.441 . . . . 999.99 110.292 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -66.3 -41.34 89.87 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.733 -0.667 . . . . 292.18 110.388 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.24 -40.07 98.62 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 115.645 -0.707 . . . . 65.97 112.417 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.45 -40.56 94.92 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.484 0.183 . . . . 184.99 111.023 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.13 -40.89 97.15 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.031 0.443 . . . . 381.14 110.659 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.02 -41.5 92.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.75 -0.659 . . . . 354.06 110.658 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -69.29 -10.04 61.96 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.677 -0.692 . . . . 88.8 114.093 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 29.0 mmt85 -78.05 -22.25 49.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.404 0.602 . . . . 999.99 111.299 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -108.42 112.81 25.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.675 0.274 . . . . 999.99 110.314 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.9 mt -126.28 113.54 34.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.108 -0.33 . . . . 458.46 110.108 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -111.62 30.1 7.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.334 -0.394 . . . . 388.05 112.014 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -61.53 -41.33 97.18 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 111.666 0.247 . . . . 538.07 111.666 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.36 94.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.168 0.509 . . . . 282.7 110.989 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -65.31 -35.76 81.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.543 -0.753 . . . . 999.99 111.764 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.418 ' O ' HD12 ' A' ' 105' ' ' LEU . 78.9 t80 -58.52 -49.37 77.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.666 0.27 . . . . 504.74 110.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -66.09 -38.2 87.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.499 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.37 -41.12 96.57 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.743 0.306 . . . . 558.87 110.349 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.07 -41.32 97.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.114 -0.494 . . . . 412.73 111.132 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.418 HD12 ' O ' ' A' ' 101' ' ' PHE . 7.3 mp -67.97 -40.9 83.09 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.009 -0.541 . . . . 665.66 111.236 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.18 -39.39 94.52 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.485 -0.325 . . . . 999.99 110.791 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.18 -41.45 83.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.095 -0.502 . . . . 746.24 111.322 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -91.46 1.41 57.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.468 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 58.66 42.21 20.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.058 -0.519 . . . . 848.93 111.512 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 97.7 mmm -102.57 101.82 12.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 999.99 110.795 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.4 mm -94.13 119.81 66.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 586.78 110.794 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.45 153.26 55.34 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.606 2.204 . . . . 310.73 112.434 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -83.91 127.37 33.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.443 -0.344 . . . . 866.09 110.508 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -69.68 122.73 19.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.122 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.9 mt -99.69 117.12 64.17 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 579.24 111.589 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.14 -24.0 38.94 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.423 2.082 . . . . 684.25 112.093 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -65.48 -25.25 67.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.553 -0.749 . . . . 662.15 111.275 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -32.36 49.96 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.018 -0.537 . . . . 999.99 111.953 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.48 -40.12 90.14 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.821 0.343 . . . . 675.31 110.799 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.75 -38.48 89.21 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.94 -0.573 . . . . 900.95 110.872 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.402 HD12 HG22 ' A' ' 121' ' ' ILE . 34.6 mm -61.17 -44.95 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.126 -0.488 . . . . 500.83 110.9 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -60.87 -38.4 85.48 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.415 -0.357 . . . . 834.99 111.304 179.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -65.48 -33.07 75.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.154 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 89.7 mmm -70.02 133.58 47.37 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.998 -0.547 . . . . 599.62 111.605 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.462 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.9 mmp_? -53.34 138.41 48.71 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.972 -0.558 . . . . 999.99 111.163 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.84 -38.99 85.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.91 2.406 . . . . 214.74 113.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -65.28 -26.54 68.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.39 -0.368 . . . . 248.66 111.711 179.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -91.68 -3.47 56.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.433 -0.349 . . . . 360.37 111.799 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 125' ' ' ARG . 59.7 t -91.99 114.99 63.8 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.662 0.268 . . . . 334.76 110.543 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.24 147.89 60.77 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.279 1.986 . . . . 351.83 112.344 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.8 m -128.89 153.03 37.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.133 -0.485 . . . . 410.42 110.323 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -128.39 137.28 51.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 999.99 110.979 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -85.21 175.65 8.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.996 -0.547 . . . . 551.94 109.907 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.3 -0.857 . . . . 965.93 110.871 -179.228 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.821 0.343 . . . . 521.04 111.032 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -87.78 154.62 53.1 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 999.99 110.758 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.05 152.41 72.96 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.544 2.163 . . . . 546.56 112.298 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -82.12 55.61 2.88 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.168 0.433 . . . . 999.99 112.168 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 49.53 64.31 1.81 Allowed 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.43 0.456 . . . . 999.99 111.939 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -55.51 132.38 48.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.08 0.467 . . . . 999.99 111.482 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -73.19 132.53 43.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.688 -0.687 . . . . 280.85 111.372 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.07 -41.94 97.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.058 -0.519 . . . . 999.99 111.044 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.564 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.53 -39.16 83.02 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.976 0.417 . . . . 200.79 111.375 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.429 ' CD1' ' HB ' ' A' ' 82' ' ' VAL . 11.9 m-30 -68.45 -34.02 75.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.133 -0.485 . . . . 518.33 109.968 179.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.39 -40.6 93.66 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.615 -0.721 . . . . 524.44 111.761 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.564 HG12 ' O ' ' A' ' 14' ' ' ALA . 9.8 p -69.79 -36.57 70.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 120.777 -0.369 . . . . 407.88 111.378 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.439 ' O ' HG13 ' A' ' 21' ' ' VAL . . . -63.78 -42.05 97.82 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 121.102 0.477 . . . . 136.03 110.477 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.89 -40.86 78.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.603 -0.726 . . . . 505.3 111.01 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.459 ' O ' HG12 ' A' ' 24' ' ' ILE . 40.2 ttpt -59.63 -45.17 92.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.726 -0.67 . . . . 703.51 112.559 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 18' ' ' ALA . 8.5 p -64.81 -33.14 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 120.861 -0.336 . . . . 324.41 111.346 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.94 -41.52 86.83 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.14 0.495 . . . . 685.46 110.22 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.05 -42.49 88.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.431 -0.804 . . . . 238.49 110.427 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 mm -60.57 -44.12 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 115.754 -0.657 . . . . 509.15 111.268 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.34 97.34 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.53 0.205 . . . . 183.06 111.353 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.37 -41.4 96.54 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 121.005 -0.617 . . . . 63.82 112.675 179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -71.92 -25.55 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.754 0.311 . . . . 351.91 111.335 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.48 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.1 t0 -76.91 -36.25 56.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 145.09 110.874 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -60.38 -46.59 89.43 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.845 -0.428 . . . . 999.99 109.845 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.97 -39.27 96.34 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.776 -0.647 . . . . 82.9 112.038 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 60.8 tp -61.64 -40.48 95.06 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 122.659 0.384 . . . . 392.81 111.379 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 28' ' ' ASP . 58.8 t -59.51 -44.26 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.762 -0.199 . . . . 455.7 110.946 -179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.4 -40.78 97.61 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.973 0.416 . . . . 756.66 110.528 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.8 t90 -65.86 -41.66 91.36 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.913 -0.585 . . . . 999.99 109.961 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.42 ' HA ' ' HA3' ' A' ' 39' ' ' GLY . 87.8 mt -61.25 -36.84 81.08 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.64 -0.709 . . . . 373.99 111.468 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.72 -37.77 85.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.551 -0.295 . . . . 811.35 111.296 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.88 -51.16 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 113.53 0.937 . . . . 461.27 113.53 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -109.95 -22.8 11.67 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.174 0.805 . . . . 575.93 113.174 -177.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 35' ' ' LEU . . . -62.38 -21.39 62.18 Favored Glycine 0 N--CA 1.461 0.335 0 C-N-CA 121.145 -0.55 . . . . 226.53 113.828 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -62.84 -18.18 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.079 0.4 . . . . 999.99 112.079 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.0 p -102.81 -6.14 22.88 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.484 0.549 . . . . 432.8 112.484 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.42 142.77 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.035 0.445 . . . . 844.62 111.719 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.3 m -77.6 161.45 27.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.725 -0.67 . . . . 316.62 110.67 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -41.27 93.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.373 -0.376 . . . . 291.13 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.467 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 58.3 t -65.55 -42.74 93.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.157 -0.474 . . . . 467.63 110.721 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.657 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 96.5 mt-30 -63.07 -41.14 99.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.007 -0.542 . . . . 430.34 111.219 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -61.51 -46.69 88.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.262 -0.426 . . . . 667.57 111.353 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.73 -40.17 91.89 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.85 0.357 . . . . 527.8 111.383 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.27 -25.27 68.24 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.046 -0.525 . . . . 169.13 112.214 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 94.0 mt -64.08 -24.37 67.67 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.01 0.744 . . . . 409.47 113.01 -178.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -60.57 -40.71 92.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 686.82 110.338 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -70.65 -37.17 73.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.24 -0.436 . . . . 213.85 110.409 178.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.63 -42.89 97.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.685 -0.689 . . . . 289.44 110.529 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -60.66 -40.13 90.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.94 -0.573 . . . . 358.19 111.173 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -60.87 -46.52 90.29 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.747 0.308 . . . . 999.99 110.414 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.42 -38.74 92.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 999.99 110.706 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.93 -49.01 79.37 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.634 -0.712 . . . . 212.58 111.685 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ptm -67.63 -37.16 82.07 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 121.065 -0.254 . . . . 262.65 111.483 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -65.61 -38.0 88.21 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 111.849 0.314 . . . . 684.75 111.849 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -60.15 -48.17 82.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.72 0.295 . . . . 450.86 111.006 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -71.34 -40.44 70.69 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.794 0.33 . . . . 587.54 111.22 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.9 t-105 -62.6 -45.7 91.68 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.418 0.525 . . . . 785.5 112.418 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.25 84.28 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 112.383 0.512 . . . . 290.18 112.383 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -62.02 -48.7 79.1 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.868 0.366 . . . . 676.15 111.155 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -72.15 -37.39 69.42 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.171 -0.468 . . . . 824.3 112.193 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 67.2 ttp -52.73 -46.79 67.57 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.396 -0.365 . . . . 839.61 111.94 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.06 -44.14 96.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.82 -0.173 . . . . 667.86 111.15 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -63.35 -47.09 83.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.983 0.42 . . . . 999.99 110.628 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.34 -42.91 98.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 115.694 -0.685 . . . . 648.32 110.979 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -59.98 -42.06 93.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.232 -0.44 . . . . 555.82 111.428 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.59 -41.39 98.92 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.938 -0.305 . . . . 912.86 110.532 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.97 -45.45 92.38 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.043 -0.526 . . . . 999.99 110.254 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.45 -44.56 99.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.667 -0.697 . . . . 322.08 110.706 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -61.1 -44.57 97.16 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.111 -0.495 . . . . 443.19 111.138 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.4 97.25 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.426 -0.352 . . . . 427.97 111.409 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.73 -39.65 80.27 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.293 -0.412 . . . . 552.67 111.291 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.43 77.46 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.178 -0.534 . . . . 282.78 112.278 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.95 152.61 38.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 999.99 111.442 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.5 p -117.95 94.48 46.43 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.371 -0.377 . . . . 423.41 110.476 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -72.12 150.27 53.62 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.762 2.308 . . . . 262.13 113.331 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.6 m -101.47 173.08 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.703 -0.68 . . . . 322.52 110.536 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.429 ' HB ' ' CD1' ' A' ' 15' ' ' PHE . 9.0 p -56.33 -26.75 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.631 -0.258 . . . . 195.73 111.643 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.26 -38.66 96.04 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 121.11 -0.567 . . . . 116.64 112.012 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -73.62 -29.07 62.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.037 0.446 . . . . 397.23 110.698 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -69.16 -24.82 64.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.637 -0.71 . . . . 273.3 112.217 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 70.2 p -59.29 -35.83 74.48 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.553 0.216 . . . . 391.43 111.127 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -62.66 -44.9 95.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.034 0.445 . . . . 999.99 110.052 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -65.44 -41.04 93.9 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.705 -0.679 . . . . 292.18 110.492 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.17 98.83 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.598 -0.728 . . . . 65.97 112.652 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.29 -40.14 93.03 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.766 0.317 . . . . 184.99 111.098 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -65.22 -41.19 94.66 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.173 -0.467 . . . . 381.14 110.205 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.52 -42.77 96.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 354.06 110.691 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.62 -36.89 92.51 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.785 -0.643 . . . . 88.8 113.445 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -79.67 -10.87 59.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.196 0.443 . . . . 999.99 112.196 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -108.37 112.47 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 999.99 111.03 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.1 pt -131.85 152.09 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.488 -0.324 . . . . 458.46 111.154 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -155.2 38.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.2 0.524 . . . . 388.05 109.791 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.452 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 24.7 ptp -74.77 -16.19 60.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.665 -0.698 . . . . 538.07 112.356 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.15 96.62 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.763 0.316 . . . . 282.7 111.356 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -71.15 -35.19 71.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.355 -0.384 . . . . 999.99 110.971 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.74 -46.68 89.5 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.09 -0.504 . . . . 504.74 110.624 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 98' ' ' MET . 45.1 m-85 -63.45 -40.94 98.47 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.623 -0.262 . . . . 999.99 110.975 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -63.52 -40.76 97.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.21 -0.45 . . . . 558.87 110.668 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.32 -41.32 98.91 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.945 -0.57 . . . . 412.73 111.25 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -42.7 99.29 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.253 -0.431 . . . . 665.66 110.786 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -64.0 -42.33 97.21 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.082 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.7 -42.65 84.14 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 746.24 111.791 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -89.41 -3.24 58.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.347 . . . . 999.99 111.396 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.89 42.95 28.27 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.58 0.55 . . . . 848.93 111.447 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mtp -99.74 84.2 2.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.211 -0.449 . . . . 999.99 111.22 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.2 mt -94.43 117.05 67.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 586.78 110.303 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.99 139.96 90.38 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.813 2.342 . . . . 310.73 112.718 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.61 144.88 28.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 866.09 110.66 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.467 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 65.1 t80 -68.55 108.78 3.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.833 0.349 . . . . 999.99 111.155 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.43 138.57 20.51 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.087 -0.506 . . . . 579.24 110.851 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.03 -33.6 96.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.836 2.357 . . . . 684.25 112.042 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -61.06 -38.78 87.42 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.393 -0.821 . . . . 662.15 111.472 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 64.4 mtt -60.18 -41.78 93.6 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.785 0.326 . . . . 999.99 110.532 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -61.88 -42.55 99.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 675.31 110.622 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.12 -41.08 99.27 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.275 -0.421 . . . . 900.95 110.935 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.94 -44.32 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.142 -0.481 . . . . 500.83 110.796 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -38.33 90.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.349 -0.387 . . . . 834.99 111.704 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.44 -35.11 79.94 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.655 0.613 . . . . 999.99 112.655 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.5 ptp -90.51 149.38 22.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.035 0.445 . . . . 599.62 112.175 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.7 mmp_? -53.51 145.61 27.74 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 115.458 -0.792 . . . . 999.99 111.211 178.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.79 -26.21 81.57 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.948 2.432 . . . . 214.74 112.87 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.401 ' HA ' ' CG2' ' A' ' 17' ' ' VAL . . . -62.35 -35.98 80.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 248.66 111.695 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.73 -1.08 57.88 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.45 -0.341 . . . . 360.37 111.785 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 94.0 t -81.87 121.99 79.71 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 334.76 110.758 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -68.56 149.1 73.86 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.39 2.06 . . . . 351.83 112.534 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.71 137.95 55.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.9 -0.591 . . . . 410.42 110.052 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -122.35 136.71 54.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 999.99 110.875 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.12 171.3 12.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 551.94 110.45 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.185 -0.912 . . . . 965.93 111.115 -179.274 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.5 t . . . . . 0 C--O 1.233 0.191 0 N-CA-C 109.904 -0.406 . . . . 521.04 109.904 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 pm0 -79.16 156.74 76.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 999.99 110.959 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -68.37 152.14 75.65 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.425 2.083 . . . . 546.56 112.573 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -109.59 151.24 27.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.399 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -82.14 73.5 9.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 999.99 111.087 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.96 151.38 14.89 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.608 -0.724 . . . . 999.99 111.351 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -61.57 129.05 39.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.354 -0.385 . . . . 280.85 110.582 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.74 -39.94 93.33 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.07 -0.514 . . . . 999.99 111.655 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.03 87.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.013 0.435 . . . . 200.79 111.422 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -70.52 -34.72 72.62 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 518.33 110.222 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -67.01 -41.14 87.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.699 -0.682 . . . . 524.44 112.07 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.425 ' CG1' ' HA ' ' A' ' 127' ' ' ALA . 30.1 m -73.8 -28.99 25.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 N-CA-C 112.033 0.383 . . . . 407.88 112.033 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.73 93.29 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.222 0.534 . . . . 136.03 109.892 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.11 -36.06 72.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.279 -0.873 . . . . 505.3 111.081 178.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.459 ' O ' HG12 ' A' ' 24' ' ' ILE . 64.4 tttm -59.11 -41.93 89.34 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.641 -0.709 . . . . 703.51 111.712 -178.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.88 -44.6 99.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.584 0.23 . . . . 324.41 110.99 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -64.71 -43.26 94.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.944 0.402 . . . . 685.46 110.955 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.4 -43.92 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 115.795 -0.639 . . . . 238.49 111.59 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 20' ' ' LYS . 29.9 mm -61.06 -41.23 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 116.373 -0.376 . . . . 509.15 111.451 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.03 95.05 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.524 0.194 . . . . 183.06 111.524 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.48 -41.37 98.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.831 -0.699 . . . . 63.82 112.548 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -74.48 -20.1 60.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.633 0.254 . . . . 351.91 111.531 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -76.13 -37.27 58.23 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.969 -0.382 . . . . 145.09 109.969 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -63.3 -40.69 98.06 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.103 -0.703 . . . . 999.99 109.103 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.511 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.81 -37.23 93.96 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.013 -0.994 . . . . 82.9 112.58 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.502 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 82.0 mt -58.76 -36.53 74.52 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.164 0.186 . . . . 392.81 111.171 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.32 -41.61 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 116.214 -0.448 . . . . 455.7 111.222 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.52 -42.57 99.01 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.525 0.202 . . . . 756.66 111.381 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.511 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 8.0 m-90 -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.531 0.205 . . . . 999.99 110.992 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.3 mt -62.78 -37.21 85.75 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.93 0.395 . . . . 373.99 110.863 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.94 -37.29 86.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.322 -0.399 . . . . 811.35 111.384 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.66 -51.99 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 113.424 0.898 . . . . 461.27 113.424 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.429 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.93 -21.26 12.73 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.967 0.728 . . . . 575.93 112.967 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.73 -37.9 93.08 Favored Glycine 0 N--CA 1.46 0.25 0 C-N-CA 121.233 -0.508 . . . . 226.53 113.325 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -61.71 -20.46 63.52 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.988 0.366 . . . . 999.99 111.988 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.3 p -105.63 -4.36 21.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.983 0.364 . . . . 432.8 111.983 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 91.0 mt -72.92 146.28 46.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.084 0.469 . . . . 844.62 111.63 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.0 m -76.82 164.55 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.808 -0.633 . . . . 316.62 110.582 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.6 m -59.67 -41.95 91.78 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.346 -0.388 . . . . 291.13 111.072 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 69.5 t -65.87 -42.47 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.26 -0.427 . . . . 467.63 110.482 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -63.28 -40.59 97.81 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.125 -0.488 . . . . 430.34 111.16 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -61.38 -46.66 89.27 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.271 -0.422 . . . . 667.57 110.784 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.58 -39.71 91.94 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.303 -0.408 . . . . 527.8 111.177 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.27 83.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.722 -0.672 . . . . 169.13 111.907 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.6 -32.08 49.64 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.77 0.656 . . . . 409.47 112.77 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -62.93 -42.88 99.94 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.801 0.334 . . . . 686.82 110.751 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -70.99 -39.27 72.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.196 0.522 . . . . 213.85 109.813 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -60.5 -41.42 87.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.252 -0.885 . . . . 289.44 111.191 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.68 -45.19 89.97 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.501 0.191 . . . . 358.19 110.921 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -65.07 -41.59 94.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.747 0.308 . . . . 999.99 110.747 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -63.9 -40.84 97.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.266 0.555 . . . . 999.99 110.253 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -58.96 -48.51 81.27 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.282 -0.872 . . . . 212.58 110.376 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -45.7 92.03 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.729 -0.669 . . . . 262.65 111.49 179.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.54 -39.65 94.29 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.264 -0.425 . . . . 684.75 111.689 -179.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.5 m -61.09 -47.06 88.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.985 0.421 . . . . 450.86 110.776 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.493 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 67.7 m80 -70.12 -38.71 75.65 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.088 -0.505 . . . . 587.54 111.346 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -60.29 -48.16 82.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.301 -0.409 . . . . 785.5 111.02 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.64 94.19 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 111.843 0.312 . . . . 290.18 111.843 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.85 -48.45 78.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.426 -0.352 . . . . 676.15 111.727 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.493 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 62.7 m-85 -71.06 -36.38 72.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.524 -0.307 . . . . 824.3 111.79 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 62.4 ttp -52.42 -44.89 65.67 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.381 0.425 . . . . 839.61 112.062 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.8 mt -61.45 -42.23 98.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.479 0.18 . . . . 667.86 111.16 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -68.84 -40.39 79.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 999.99 110.593 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.411 ' O ' HG12 ' A' ' 73' ' ' ILE . 95.1 mt -63.65 -44.84 98.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.761 -0.654 . . . . 648.32 110.883 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.69 -39.43 88.46 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.282 -0.417 . . . . 555.82 111.567 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.28 -48.19 82.8 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.857 0.361 . . . . 912.86 110.496 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.7 tptm -64.79 -45.11 87.68 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.858 -0.61 . . . . 999.99 111.092 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 69' ' ' ILE . 37.4 mm -62.96 -45.8 97.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.028 -0.533 . . . . 322.08 111.948 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -61.6 -40.46 94.9 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.745 -0.207 . . . . 443.19 110.997 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.5 95.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.345 . . . . 427.97 111.135 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.9 mt -70.06 -39.94 75.36 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.189 -0.46 . . . . 552.67 111.425 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.9 -8.82 79.26 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 121.107 -0.568 . . . . 282.78 112.411 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -74.73 152.07 39.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.622 0.249 . . . . 999.99 111.318 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -115.2 94.36 38.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.51 -0.314 . . . . 423.41 110.987 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.34 143.23 97.78 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.323 2.682 . . . . 262.13 113.446 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.431 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 16.2 m -100.76 -177.82 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.842 -0.617 . . . . 322.52 110.607 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.1 t -58.13 -42.48 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-N 116.421 -0.354 . . . . 195.73 110.88 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.629 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -39.47 96.83 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.894 -0.669 . . . . 116.64 112.28 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.21 -38.52 91.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 397.23 111.428 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . 0.431 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 39.3 m-85 -67.91 -26.4 65.97 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.749 0.648 . . . . 273.3 112.749 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.629 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -57.14 -34.66 68.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 121.004 -0.278 . . . . 391.43 111.218 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -65.53 -41.11 93.43 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.954 0.407 . . . . 999.99 110.484 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.93 -40.96 87.75 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.796 -0.638 . . . . 292.18 110.493 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.74 -40.73 99.57 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.626 -0.715 . . . . 65.97 112.178 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.96 -39.77 93.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.636 0.255 . . . . 184.99 110.933 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.05 -40.48 94.8 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.254 -0.43 . . . . 381.14 110.595 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.93 -42.57 96.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.897 -0.592 . . . . 354.06 110.348 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -65.05 -17.33 63.27 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.787 -0.642 . . . . 88.8 113.437 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -80.09 -13.03 59.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.987 0.394 . . . . 999.99 111.178 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -107.48 112.1 24.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 999.99 110.282 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 78.2 mt -125.4 125.95 69.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.292 -0.413 . . . . 458.46 110.746 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -130.6 48.53 2.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.077 0.465 . . . . 388.05 110.516 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.45 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 67.2 mtt -66.77 -35.54 80.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.654 -0.703 . . . . 538.07 111.661 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.4 -38.12 79.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.32 -0.4 . . . . 282.7 111.33 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -59.27 -47.13 86.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.272 -0.422 . . . . 999.99 110.397 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -58.62 -48.26 81.59 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.106 -0.497 . . . . 504.74 111.249 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.45 ' HD1' ' O ' ' A' ' 98' ' ' MET . 58.1 m-85 -62.81 -41.63 99.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.768 0.318 . . . . 999.99 110.985 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -64.23 -43.6 94.45 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.076 -0.511 . . . . 558.87 111.224 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.77 -41.36 97.6 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.154 -0.475 . . . . 412.73 111.721 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.91 -48.48 76.43 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.465 -0.334 . . . . 665.66 111.08 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.94 -40.21 95.91 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.678 0.275 . . . . 999.99 111.283 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.62 -44.67 90.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.19 -0.459 . . . . 746.24 111.959 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -86.53 -11.26 52.13 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.897 0.332 . . . . 999.99 111.897 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.07 39.94 31.73 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.397 0.435 . . . . 848.93 111.778 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mmm -109.68 108.8 19.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.871 0.367 . . . . 999.99 111.483 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.46 120.02 65.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 586.78 110.126 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.61 146.14 54.12 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.279 1.986 . . . . 310.73 112.754 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -84.94 142.26 29.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 866.09 110.692 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.34 109.6 4.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.401 -0.363 . . . . 999.99 110.969 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.59 126.02 40.64 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.437 -0.347 . . . . 579.24 111.011 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -56.91 -32.63 93.05 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.042 2.495 . . . . 684.25 112.355 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -59.74 -45.28 92.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.758 -0.655 . . . . 662.15 111.642 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 77.9 mtm -60.16 -40.89 91.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.695 0.283 . . . . 999.99 110.253 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 55.2 tp10 -60.79 -43.0 98.68 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.976 -0.557 . . . . 675.31 110.104 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 124' ' ' MET . 88.9 tt0 -61.62 -44.74 96.43 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.813 -0.63 . . . . 900.95 110.973 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.8 mm -61.53 -43.74 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 CA-C-N 116.419 -0.355 . . . . 500.83 111.392 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -61.8 -38.66 88.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.624 0.25 . . . . 834.99 111.474 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -66.44 -32.66 74.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.338 -0.392 . . . . 999.99 111.771 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.494 ' HG2' ' O ' ' A' ' 120' ' ' GLU . 26.5 mmt -70.43 141.31 52.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.503 -0.317 . . . . 599.62 111.416 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.483 ' O ' HG21 ' A' ' 129' ' ' VAL . 95.7 mtm-85 -52.26 139.46 35.98 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 115.776 -0.647 . . . . 999.99 111.044 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -60.44 -25.97 81.7 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.734 2.289 . . . . 214.74 112.794 -179.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.425 ' HA ' ' CG1' ' A' ' 17' ' ' VAL . . . -62.22 -36.7 82.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 248.66 111.43 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -92.12 -0.09 57.45 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.191 0.441 . . . . 360.37 112.191 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . 0.483 HG21 ' O ' ' A' ' 125' ' ' ARG . 63.0 t -89.59 117.55 68.25 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.692 0.282 . . . . 334.76 111.305 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -72.83 160.85 45.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.814 2.343 . . . . 351.83 112.388 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 92.3 t -106.18 137.19 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.936 0.398 . . . . 410.42 110.444 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -96.4 126.94 41.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 999.99 110.891 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -82.76 149.66 27.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 551.94 110.15 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.3 mmt . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.471 -0.776 . . . . 965.93 110.767 -179.718 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.7 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.766 0.317 . . . . 521.04 111.037 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.29 126.49 60.36 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.967 -0.561 . . . . 999.99 110.704 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -56.55 134.66 65.79 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.712 2.275 . . . . 546.56 112.2 179.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -125.59 -47.07 1.71 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.465 -0.334 . . . . 999.99 111.838 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -105.28 -7.79 18.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.327 0.491 . . . . 999.99 112.327 -178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.81 138.99 56.93 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.886 0.374 . . . . 999.99 111.573 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -100.3 118.51 36.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 280.85 110.179 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -61.6 -38.94 89.43 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.003 -0.544 . . . . 999.99 111.643 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.03 87.29 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.856 0.36 . . . . 200.79 111.396 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -70.07 -30.72 68.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 518.33 110.03 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -64.38 -39.05 93.11 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.746 -0.661 . . . . 524.44 109.526 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.31 -44.88 96.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.51 -0.768 . . . . 407.88 111.017 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.539 ' O ' HG11 ' A' ' 21' ' ' VAL . . . -61.89 -38.77 89.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.151 0.501 . . . . 136.03 110.397 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.6 -39.61 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.759 -0.655 . . . . 505.3 111.085 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.23 -41.24 92.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.81 0.671 . . . . 703.51 112.81 -178.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.539 HG11 ' O ' ' A' ' 18' ' ' ALA . 9.9 p -66.03 -36.36 77.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 120.719 -0.393 . . . . 324.41 111.208 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.422 ' OE1' ' HA ' ' A' ' 86' ' ' THR . 63.1 tt0 -67.02 -39.98 87.15 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.101 0.477 . . . . 685.46 110.249 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.683 HG23 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -62.89 -43.52 98.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 115.544 -0.753 . . . . 238.49 110.436 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.8 mm -60.09 -43.91 93.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-N 115.511 -0.768 . . . . 509.15 111.775 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.96 95.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.013 0.375 . . . . 183.06 112.013 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.3 -42.83 95.95 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.731 -0.747 . . . . 63.82 113.103 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -74.69 -19.81 60.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.056 0.391 . . . . 351.91 112.056 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.454 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.7 t0 -76.42 -39.48 53.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.738 -0.21 . . . . 145.09 111.182 -178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -62.55 -43.33 99.08 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.947 0.403 . . . . 999.99 109.944 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.31 -39.58 94.37 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.691 -0.686 . . . . 82.9 112.225 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -63.24 -42.56 99.24 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 122.33 0.252 . . . . 392.81 111.209 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 28' ' ' ASP . 63.0 t -60.94 -46.03 97.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.567 -0.288 . . . . 455.7 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -63.17 -41.25 99.2 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.848 0.356 . . . . 756.66 110.636 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -63.92 -44.13 93.83 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.337 0.589 . . . . 999.99 109.978 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.7 tp -60.77 -39.07 87.43 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.104 -0.953 . . . . 373.99 111.42 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -64.4 -25.01 67.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.907 0.336 . . . . 811.35 111.907 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.3 t -86.81 -51.06 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 N-CA-C 113.128 0.788 . . . . 461.27 113.128 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.643 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.1 m-70 -98.98 -4.03 33.56 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.737 0.643 . . . . 575.93 112.737 -178.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.49 -34.9 70.16 Favored Glycine 0 N--CA 1.46 0.289 0 CA-C-N 116.169 -0.468 . . . . 226.53 114.086 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -62.26 -19.91 63.71 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.098 0.407 . . . . 999.99 112.098 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.2 p -111.69 -13.06 13.8 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.792 0.664 . . . . 432.8 112.792 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 95.1 mt -72.96 137.27 45.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.804 0.335 . . . . 844.62 111.815 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.5 p -78.04 165.47 23.98 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.305 -0.407 . . . . 316.62 110.359 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.8 m -61.76 -44.15 97.45 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.771 0.319 . . . . 291.13 111.188 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 70.6 t -66.91 -43.69 89.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.219 -0.446 . . . . 467.63 111.035 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.463 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 64.9 tt0 -63.11 -40.78 98.62 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.453 . . . . 430.34 111.12 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.36 -47.12 87.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.311 -0.404 . . . . 667.57 111.241 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.88 -40.38 95.02 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.906 0.384 . . . . 527.8 110.914 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.68 86.13 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.711 -0.677 . . . . 169.13 111.647 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 83.9 mt -60.61 -35.63 76.61 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.899 0.703 . . . . 409.47 112.899 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -59.67 -41.24 90.16 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.969 -0.382 . . . . 686.82 109.969 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -68.69 -39.41 80.53 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.217 -0.447 . . . . 213.85 109.898 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.32 -41.29 86.64 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 CA-C-N 115.877 -0.601 . . . . 289.44 110.442 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -59.11 -42.43 90.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.427 -0.351 . . . . 358.19 110.394 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.642 ' O ' ' HG2' ' A' ' 58' ' ' MET . 98.7 mtt180 -64.77 -42.54 95.04 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.18 -0.464 . . . . 999.99 110.439 178.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -65.31 -42.71 92.72 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.496 0.665 . . . . 999.99 110.633 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -60.59 -47.02 88.05 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.96 -1.018 . . . . 212.58 111.865 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.683 ' SD ' HG23 ' A' ' 23' ' ' ILE . 14.0 ptt? -58.98 -39.27 81.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.745 0.307 . . . . 262.65 110.852 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.445 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 98.3 mm-40 -69.63 -39.05 77.39 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.189 -0.46 . . . . 684.75 111.2 179.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.7 m -61.44 -48.01 83.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.288 -0.414 . . . . 450.86 110.959 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.6 -48.53 79.0 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.083 -0.508 . . . . 587.54 110.827 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.4 t-105 -64.85 -40.24 94.84 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.912 0.708 . . . . 785.5 112.912 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 59' ' ' GLN . . . -56.93 -37.9 72.13 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.915 0.709 . . . . 290.18 112.915 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.68 -46.97 87.46 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.674 0.273 . . . . 676.15 110.977 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -77.83 -41.1 38.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.418 -0.355 . . . . 824.3 111.127 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.6 ttt -53.6 -45.02 69.88 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.013 0.745 . . . . 839.61 113.013 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.2 tp -57.81 -45.46 86.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.014 0.375 . . . . 667.86 112.014 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -65.56 -40.87 93.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 999.99 111.172 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mm -70.63 -42.97 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.115 -0.493 . . . . 648.32 111.082 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -60.66 -38.9 86.41 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.805 -0.634 . . . . 555.82 111.925 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.22 -46.33 88.76 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 110.261 -0.274 . . . . 912.86 110.261 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.79 -41.28 92.18 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.357 -0.383 . . . . 999.99 111.071 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.05 -45.69 98.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.381 -0.372 . . . . 322.08 110.998 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.85 -43.1 99.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.175 -0.466 . . . . 443.19 111.124 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.51 -40.26 96.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.348 -0.387 . . . . 427.97 111.09 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.58 -38.54 80.78 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.169 -0.469 . . . . 552.67 111.343 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.7 5.02 75.16 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.952 -0.642 . . . . 282.78 112.48 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -74.18 147.56 42.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.867 0.365 . . . . 999.99 111.269 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -102.9 109.39 61.23 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 423.41 110.812 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -59.43 138.44 84.17 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.746 2.297 . . . . 262.13 112.549 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.9 m -102.37 172.61 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.447 . . . . 322.52 111.692 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.3 t -61.16 -41.13 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 115.68 -0.691 . . . . 195.73 110.97 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.536 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.02 -41.88 98.14 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.782 -0.723 . . . . 116.64 112.398 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.84 -40.13 94.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.128 0.489 . . . . 397.23 110.216 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -66.63 -39.88 88.48 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.517 -0.765 . . . . 273.3 111.591 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.536 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.9 OUTLIER -64.22 -34.33 77.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.988 -0.285 . . . . 391.43 111.025 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.73 -40.99 92.74 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.212 0.529 . . . . 999.99 109.593 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.98 -38.61 86.38 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.327 -0.851 . . . . 292.18 110.476 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.99 -39.18 95.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.621 -0.718 . . . . 65.97 113.067 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.7 97.12 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.895 0.379 . . . . 184.99 110.2 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.4 -40.39 89.58 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.839 -0.619 . . . . 381.14 110.363 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -61.61 -45.6 98.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.729 -0.669 . . . . 354.06 111.321 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -81.9 -2.56 90.59 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.937 -0.649 . . . . 88.8 113.64 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -79.45 -30.67 42.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.123 0.461 . . . . 999.99 110.953 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -108.63 112.65 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.512 -0.313 . . . . 999.99 110.937 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.7 mm -124.89 125.55 69.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.585 -0.524 . . . . 458.46 109.585 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -141.76 68.97 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.894 0.378 . . . . 388.05 111.582 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.3 mmm -70.97 -28.21 64.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.86 -0.609 . . . . 538.07 111.192 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.21 -38.16 82.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.66 -0.7 . . . . 282.7 112.031 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -59.24 -48.8 80.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.4 -0.363 . . . . 999.99 111.135 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -60.01 -46.81 88.26 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.585 -0.279 . . . . 504.74 110.962 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -58.44 -47.44 83.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.037 -0.529 . . . . 999.99 111.141 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.7 -46.08 91.75 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.578 -0.283 . . . . 558.87 110.804 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.16 98.08 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.256 -0.429 . . . . 412.73 111.378 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.49 -45.23 93.96 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.981 -0.554 . . . . 665.66 110.956 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -62.75 -39.31 93.71 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.243 -0.435 . . . . 999.99 110.782 179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.13 -40.95 82.61 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.962 -0.563 . . . . 746.24 111.39 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -83.41 -11.73 57.25 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.518 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.5 t30 54.06 45.99 26.39 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 122.96 0.504 . . . . 848.93 111.781 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.4 mtp -107.91 113.85 27.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.881 0.372 . . . . 999.99 111.361 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.8 mt -94.33 118.73 67.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 586.78 110.185 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.66 139.51 34.11 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.307 2.005 . . . . 310.73 112.97 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -86.07 141.27 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 866.09 110.692 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -68.66 119.93 13.86 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.714 0.292 . . . . 999.99 110.615 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -98.59 123.83 48.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.47 -0.332 . . . . 579.24 111.322 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -57.83 -31.74 93.19 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.953 2.435 . . . . 684.25 112.449 178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -61.24 -28.17 68.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.696 -0.684 . . . . 662.15 111.702 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.06 -37.66 80.53 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.337 -0.392 . . . . 999.99 111.093 -179.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.58 -40.32 91.28 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 675.31 110.933 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.27 -40.55 96.22 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.475 -0.329 . . . . 900.95 110.978 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.2 mm -61.43 -45.72 98.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.152 -0.477 . . . . 500.83 110.673 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -39.1 93.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.817 -0.628 . . . . 834.99 111.995 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 54.8 mmm-85 -67.72 -34.25 76.49 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.2 ptp -81.3 151.02 28.25 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.129 0.49 . . . . 599.62 112.252 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -51.75 134.52 36.54 Favored Pre-proline 0 N--CA 1.466 0.353 0 CA-C-N 115.285 -0.87 . . . . 999.99 111.457 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -53.12 -32.59 59.94 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.303 2.668 . . . . 214.74 113.171 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.07 -36.25 76.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 248.66 111.663 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -91.87 8.14 38.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.453 -0.34 . . . . 360.37 111.736 -179.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 72.8 t -91.43 114.78 62.87 Favored Pre-proline 0 C--O 1.234 0.244 0 CA-C-O 120.818 0.342 . . . . 334.76 110.965 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.46 157.59 49.02 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.676 2.251 . . . . 351.83 112.772 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.445 ' HB ' ' HG3' ' A' ' 59' ' ' GLN . 16.7 m -126.84 158.82 37.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.074 -0.512 . . . . 410.42 110.593 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -113.98 128.94 56.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.881 0.372 . . . . 999.99 111.297 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -83.17 161.62 21.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.928 -0.578 . . . . 551.94 109.985 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.173 -0.918 . . . . 965.93 110.687 -179.411 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 40.4 ttp-105 . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.951 0.405 . . . . 999.99 111.896 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -142.47 152.21 42.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 999.99 110.666 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -153.06 162.25 41.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.308 -0.405 . . . . 999.99 109.91 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -108.15 140.07 41.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.454 -0.339 . . . . 999.99 110.344 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -85.48 108.25 17.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.009 0.433 . . . . 999.99 110.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.6 t -125.08 127.42 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 521.04 110.031 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -91.11 116.1 65.74 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.682 -0.236 . . . . 999.99 110.418 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.453 ' HA ' ' OD1' ' A' ' 74' ' ' ASP . 59.9 Cg_endo -72.4 140.2 33.04 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.135 . . . . 546.56 112.783 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -99.68 -12.7 19.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 999.99 111.17 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -107.98 10.79 28.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.087 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.05 124.62 19.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.856 -0.611 . . . . 999.99 111.909 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.512 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.5 t-20 -109.98 110.34 21.23 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.311 -0.626 . . . . 280.85 109.311 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.08 -39.34 92.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.294 0.479 . . . . 999.99 112.294 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' O ' HG11 ' A' ' 17' ' ' VAL . . . -59.83 -41.21 90.83 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.95 0.352 . . . . 200.79 111.95 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -72.56 -27.71 62.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.411 -0.358 . . . . 518.33 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 12' ' ' ASN . 78.2 mm-40 -63.97 -40.04 95.51 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.104 -0.498 . . . . 524.44 112.115 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.501 HG11 ' O ' ' A' ' 14' ' ' ALA . 9.3 p -67.27 -36.07 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 120.757 -0.377 . . . . 407.88 110.938 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.84 -42.61 99.81 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.195 0.521 . . . . 136.03 109.98 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.6 tp -66.08 -42.68 89.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.23 -0.895 . . . . 505.3 110.758 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.16 -41.75 93.45 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.588 -0.733 . . . . 703.51 111.603 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' ' 17' ' ' VAL . 65.7 t -63.15 -43.09 98.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 116.61 -0.268 . . . . 324.41 111.067 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.08 -40.97 97.41 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.884 0.374 . . . . 685.46 110.564 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.58 -43.92 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 115.829 -0.623 . . . . 238.49 111.025 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.3 mt -61.02 -44.16 97.64 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 116.124 -0.489 . . . . 509.15 111.388 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.13 -43.52 95.63 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.58 0.229 . . . . 183.06 111.222 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.78 -39.39 96.59 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 121.146 -0.549 . . . . 63.82 112.435 178.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -72.38 -20.59 61.42 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.6 0.36 . . . . 351.91 111.718 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -78.1 -23.57 47.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.183 -0.207 . . . . 145.09 111.535 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.492 ' O ' HG13 ' A' ' 32' ' ' VAL . 95.6 mtt-85 -65.48 -42.48 92.17 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.089 0.471 . . . . 999.99 110.026 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -25.14 73.58 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.722 -0.672 . . . . 82.9 112.636 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.0 tp -63.09 -44.68 95.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.592 0.234 . . . . 392.81 111.248 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 29' ' ' ARG . 10.0 p -66.41 -31.73 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.462 -0.335 . . . . 455.7 111.137 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.51 -40.58 95.9 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.971 0.415 . . . . 756.66 110.258 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.3 t90 -67.07 -38.94 86.66 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.706 -0.679 . . . . 999.99 109.292 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.5 mt -61.37 -36.34 79.97 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.029 -0.987 . . . . 373.99 111.298 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -65.5 -21.27 66.61 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.058 0.392 . . . . 811.35 112.058 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 63.6 t -86.43 -47.59 16.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 112.521 0.563 . . . . 461.27 112.521 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.14 17.23 21.84 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.279 0.474 . . . . 575.93 112.279 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.81 -39.29 96.6 Favored Glycine 0 CA--C 1.518 0.239 0 N-CA-C 114.446 0.538 . . . . 226.53 114.446 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.2 ptt180 -63.27 -26.32 68.72 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.492 0.553 . . . . 999.99 112.492 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 p -113.15 8.11 18.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.96 0.356 . . . . 432.8 111.96 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.4 tp -72.39 121.98 20.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.805 0.336 . . . . 844.62 111.535 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.6 p -80.78 169.24 17.84 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.385 -0.371 . . . . 316.62 110.258 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.3 m -62.38 -43.96 97.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.741 0.305 . . . . 291.13 111.209 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -28.42 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 467.63 112.539 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.403 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 15.0 mm100 -62.71 -39.45 94.08 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.42 0.155 . . . . 430.34 111.42 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -60.57 -46.84 88.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.86 0.362 . . . . 667.57 110.202 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.91 -38.6 86.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.872 -0.604 . . . . 527.8 110.794 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.01 81.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.662 -0.699 . . . . 169.13 111.496 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.4 mt -60.88 -36.41 79.12 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.158 -0.474 . . . . 409.47 111.796 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -61.07 -39.49 90.1 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.372 -0.603 . . . . 686.82 109.372 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -65.97 -40.94 91.71 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.619 -0.719 . . . . 213.85 109.603 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.57 -41.97 92.28 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 115.729 -0.669 . . . . 289.44 110.448 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -59.49 -41.65 90.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.927 -0.579 . . . . 358.19 110.821 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.2 -41.95 96.84 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.068 -0.253 . . . . 999.99 110.619 178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -64.79 -40.23 94.9 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.29 0.567 . . . . 999.99 109.982 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -60.42 -46.62 89.37 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.083 -0.962 . . . . 212.58 110.234 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ttt -59.11 -43.65 91.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.772 -0.649 . . . . 262.65 110.795 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -62.72 -42.61 99.74 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.799 0.333 . . . . 684.75 110.993 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.1 m -68.32 -42.89 78.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.22 0.533 . . . . 450.86 110.861 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.421 ' NE2' ' HE1' ' A' ' 65' ' ' TYR . 71.7 t60 -63.27 -38.74 92.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.512 -0.767 . . . . 587.54 110.759 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -55.95 -32.66 64.04 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.893 -0.594 . . . . 785.5 112.553 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.74 -38.68 78.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 290.18 111.681 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -43.46 97.45 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.897 0.379 . . . . 676.15 111.73 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.421 ' HE1' ' NE2' ' A' ' 61' ' ' HIS . 76.8 m-85 -84.74 -20.45 31.07 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.706 0.632 . . . . 824.3 112.706 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.7 ttt -50.92 -50.19 58.16 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.568 0.581 . . . . 839.61 112.568 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 87.3 mt -64.6 -41.9 95.92 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 111.9 0.333 . . . . 667.86 111.9 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -71.26 -52.76 17.15 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.398 0.888 . . . . 999.99 113.398 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.1 mt -84.85 -60.09 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 114.752 1.39 . . . . 648.32 114.752 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.23 -42.19 99.21 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.373 1.249 . . . . 555.82 114.373 -175.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 40.2 ttpt -62.22 -45.91 91.24 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.739 -0.384 . . . . 912.86 111.297 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -65.13 -42.43 93.86 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.92 0.341 . . . . 999.99 111.92 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.2 mt -62.88 -46.78 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.628 0.251 . . . . 322.08 111.203 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.453 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 36.6 t70 -63.0 -45.6 91.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.355 -0.384 . . . . 443.19 111.468 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.01 -40.63 96.78 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.069 0.396 . . . . 427.97 112.069 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.14 -39.18 79.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.319 . . . . 552.67 111.522 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.03 -3.47 84.55 Favored Glycine 0 CA--C 1.518 0.27 0 C-N-CA 120.844 -0.693 . . . . 282.78 112.311 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -74.15 149.87 40.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.826 0.346 . . . . 999.99 111.036 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.0 p -112.63 95.31 32.03 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.338 -0.392 . . . . 423.41 111.059 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.86 146.08 98.06 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.061 2.507 . . . . 262.13 112.463 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.92 -179.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 322.52 111.232 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.69 -42.33 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.28 -0.418 . . . . 195.73 111.157 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.557 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.58 -40.45 97.87 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.682 -0.771 . . . . 116.64 112.143 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.81 -40.95 96.05 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.902 0.382 . . . . 397.23 110.718 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -68.55 -37.69 80.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.868 -0.605 . . . . 273.3 112.278 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -61.48 -35.15 76.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.917 -0.313 . . . . 391.43 111.077 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.2 mmm180 -66.75 -40.65 88.39 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.171 0.51 . . . . 999.99 110.092 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.46 -38.89 88.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.499 -0.773 . . . . 292.18 110.585 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.65 -39.04 96.01 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.536 -0.756 . . . . 65.97 112.615 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.07 96.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.617 0.246 . . . . 184.99 110.802 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -66.25 -41.67 89.66 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.98 0.419 . . . . 381.14 110.335 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.01 -43.41 97.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.931 -0.577 . . . . 354.06 110.796 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -79.08 -2.05 86.42 Favored Glycine 0 CA--C 1.519 0.342 0 CA-C-N 116.022 -0.535 . . . . 88.8 113.43 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -77.38 -31.34 54.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 999.99 110.709 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -103.48 112.55 25.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 999.99 110.152 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.5 mt -128.18 124.01 61.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.367 -0.379 . . . . 458.46 110.059 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -140.46 70.96 1.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.887 0.375 . . . . 388.05 111.097 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 61.8 mtt -70.31 -28.17 64.96 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.969 -0.559 . . . . 538.07 111.19 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.24 82.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.918 -0.583 . . . . 282.7 111.285 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -59.52 -47.82 84.03 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.241 -0.436 . . . . 999.99 110.83 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -60.29 -47.76 84.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.345 -0.389 . . . . 504.74 110.304 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -59.83 -47.87 83.96 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.765 -0.652 . . . . 999.99 111.154 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -60.84 -46.7 89.53 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.41 -0.359 . . . . 558.87 111.255 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.83 98.69 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.459 -0.337 . . . . 412.73 111.388 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.25 -44.27 92.29 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.077 -0.51 . . . . 665.66 110.783 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -63.68 -41.91 98.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.673 -0.694 . . . . 999.99 110.952 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.83 -42.83 85.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.09 -0.504 . . . . 746.24 112.171 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -88.43 -7.9 55.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.173 -0.211 . . . . 999.99 111.493 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.04 39.04 31.43 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.081 0.771 . . . . 848.93 113.081 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.15 61.26 1.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.882 0.373 . . . . 999.99 110.743 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.0 mt -82.13 121.7 79.01 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.222 -0.445 . . . . 586.78 110.699 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.94 152.73 63.44 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.563 2.176 . . . . 310.73 112.548 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -74.79 136.3 41.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 866.09 110.767 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -69.58 90.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 999.99 110.963 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.16 145.36 29.87 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.009 -0.541 . . . . 579.24 111.564 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.06 -30.28 47.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.555 2.17 . . . . 684.25 112.35 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -63.29 -45.48 91.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.102 -0.499 . . . . 662.15 110.185 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 98.1 mtp -62.36 -40.24 95.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.927 -0.579 . . . . 999.99 110.164 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.26 -41.6 97.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.535 -0.757 . . . . 675.31 110.535 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.22 -39.42 93.93 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.838 -0.619 . . . . 900.95 110.883 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 90.0 mt -61.51 -44.0 97.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 116.086 -0.506 . . . . 500.83 110.872 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.08 -36.38 83.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 834.99 111.147 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -70.54 -16.12 62.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 999.99 112.229 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 75.1 mtm -69.93 140.07 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.973 -0.291 . . . . 599.62 110.811 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.473 ' O ' HG22 ' A' ' 129' ' ' VAL . 59.6 ttp180 -51.41 129.82 33.57 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.857 -0.611 . . . . 999.99 111.367 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -53.15 -34.74 70.18 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.383 2.722 . . . . 214.74 113.326 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.51 76.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 248.66 111.838 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -91.11 0.48 57.53 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.946 0.35 . . . . 360.37 111.946 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 125' ' ' ARG . 58.4 t -98.19 111.11 58.72 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.715 0.293 . . . . 334.76 111.138 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.39 151.03 82.24 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.084 2.523 . . . . 351.83 112.301 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.98 142.72 32.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.984 0.421 . . . . 410.42 110.704 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -132.78 148.14 52.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.91 -0.586 . . . . 999.99 110.557 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -83.99 173.92 10.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 551.94 110.349 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.237 -0.887 . . . . 965.93 110.921 -178.94 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 112.412 0.523 . . . . 999.99 112.412 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.3 m -145.11 155.29 43.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.932 0.396 . . . . 999.99 111.535 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -116.09 147.42 41.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.033 -0.53 . . . . 999.99 110.794 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -97.5 8.58 44.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 999.99 111.002 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.93 -100.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 999.99 110.484 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.2 t -126.89 127.84 70.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.437 -0.209 . . . . 521.04 110.437 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.76 129.25 65.9 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.599 -0.273 . . . . 999.99 110.311 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.73 130.03 15.28 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.315 2.01 . . . . 546.56 113.258 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -124.84 1.69 8.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 999.99 110.918 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -104.73 8.93 35.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.376 . . . . 999.99 111.81 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.3 mt -56.78 113.7 1.76 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.893 0.378 . . . . 999.99 111.767 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -114.37 115.01 26.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.722 -0.473 . . . . 280.85 109.722 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -61.7 -39.76 92.59 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.474 -0.33 . . . . 999.99 111.74 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -40.41 89.34 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.968 0.413 . . . . 200.79 111.644 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -71.35 -31.39 67.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.095 -0.502 . . . . 518.33 110.492 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -65.14 -41.19 95.03 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.824 -0.626 . . . . 524.44 112.016 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.437 ' CG1' ' HA ' ' A' ' 127' ' ' ALA . 18.7 m -73.99 -29.83 26.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.731 -0.388 . . . . 407.88 111.455 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.92 -40.04 95.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.561 0.696 . . . . 136.03 109.262 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.455 ' O ' HG12 ' A' ' 23' ' ' ILE . 61.2 tp -64.64 -39.64 94.06 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.712 -1.131 . . . . 505.3 111.082 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.479 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 98.2 mttt -59.58 -40.5 87.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.191 -0.459 . . . . 703.51 111.155 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 24' ' ' ILE . 77.6 t -65.42 -44.32 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.879 0.371 . . . . 324.41 111.199 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -66.12 -42.23 89.47 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.775 0.657 . . . . 685.46 112.775 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 19' ' ' LEU . 44.0 pt -81.42 -27.64 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 113.394 0.887 . . . . 238.49 113.394 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.53 HG23 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -58.43 -35.73 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.534 0.207 . . . . 509.15 111.513 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.66 92.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 183.06 111.237 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.57 -41.74 89.47 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.158 -0.544 . . . . 63.82 112.828 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.407 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 37.8 m-85 -71.17 -24.97 62.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.635 0.235 . . . . 351.91 111.635 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.454 ' O ' HG22 ' A' ' 32' ' ' VAL . 34.7 t70 -75.45 -38.84 59.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.719 -0.219 . . . . 145.09 110.899 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.58 -41.28 98.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.924 0.392 . . . . 999.99 110.01 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.81 -39.97 96.99 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.732 -0.667 . . . . 82.9 112.275 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 27' ' ' PHE . 86.4 mt -64.59 -38.81 92.3 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.466 0.173 . . . . 392.81 111.466 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.454 HG22 ' O ' ' A' ' 28' ' ' ASP . 60.6 t -60.25 -46.0 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.67 -0.241 . . . . 455.7 110.878 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -63.59 -40.59 97.33 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.052 0.454 . . . . 756.66 110.389 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -64.49 -42.24 95.97 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.695 -0.684 . . . . 999.99 110.279 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.98 -36.94 82.99 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.816 -0.629 . . . . 373.99 111.296 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -61.6 -37.61 84.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.708 0.29 . . . . 811.35 111.275 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.4 t -87.35 -50.51 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 113.378 0.881 . . . . 461.27 113.378 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.567 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.13 -29.46 8.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.251 0.834 . . . . 575.93 113.251 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.7 -35.09 84.93 Favored Glycine 0 N--CA 1.462 0.37 0 CA-C-N 116.588 -0.278 . . . . 226.53 113.793 -178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -58.2 -39.49 79.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.961 0.356 . . . . 999.99 111.961 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.9 p -87.3 -10.15 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.749 0.648 . . . . 432.8 112.749 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 98.0 mt -73.39 150.98 41.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.134 0.492 . . . . 844.62 111.963 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.4 m -77.08 162.79 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.673 . . . . 316.62 110.565 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.5 m -59.9 -41.13 90.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.216 -0.447 . . . . 291.13 111.187 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 77.8 t -65.64 -41.71 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.27 -0.423 . . . . 467.63 110.642 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.94 -39.84 95.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.085 -0.507 . . . . 430.34 110.913 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -61.83 -44.25 97.22 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.238 -0.437 . . . . 667.57 110.789 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -39.31 93.84 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.277 -0.42 . . . . 527.8 110.92 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -23.89 66.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.777 -0.647 . . . . 169.13 112.149 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.2 -37.36 82.7 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.285 0.476 . . . . 409.47 112.285 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -59.01 -46.94 86.93 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.157 -0.683 . . . . 686.82 109.157 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -62.21 -44.23 97.04 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.422 -0.808 . . . . 213.85 110.421 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.4 t -61.15 -42.46 93.38 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 CA-C-N 116.451 -0.341 . . . . 289.44 110.492 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.45 -40.33 90.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.229 -0.441 . . . . 358.19 111.051 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -61.15 -46.96 88.38 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.001 -0.37 . . . . 999.99 110.001 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -64.73 -39.37 93.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.375 0.607 . . . . 999.99 110.21 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' A' ' 96' ' ' ILE . 90.9 t80 -58.36 -47.75 82.81 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.121 -0.945 . . . . 212.58 110.586 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.0 ttt -60.48 -45.24 94.48 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 262.65 110.816 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -62.32 -39.26 92.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 684.75 111.653 -179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.9 m -60.51 -48.24 82.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.397 -0.365 . . . . 450.86 110.976 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.48 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 82.7 m-70 -70.22 -39.13 75.29 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.425 -0.352 . . . . 587.54 111.204 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -61.4 -45.43 94.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.966 -0.561 . . . . 785.5 111.452 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.28 87.56 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 111.729 0.27 . . . . 290.18 111.729 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -62.78 -46.08 89.66 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.928 0.394 . . . . 676.15 111.129 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.48 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 48.9 m-85 -70.68 -33.82 71.32 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.137 -0.483 . . . . 824.3 111.761 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 1.8 mmt -49.09 -41.33 35.31 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.909 0.707 . . . . 839.61 112.909 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.4 mt -61.96 -43.91 97.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.718 0.294 . . . . 667.86 111.111 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -70.17 -43.93 69.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 999.99 111.051 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.454 ' O ' HG12 ' A' ' 73' ' ' ILE . 97.2 mt -63.65 -47.92 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 115.619 -0.719 . . . . 648.32 111.922 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -62.55 -40.64 97.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.317 -0.401 . . . . 555.82 111.685 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.7 -46.8 89.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.671 -0.24 . . . . 912.86 110.918 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -65.85 -41.79 91.28 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.555 -0.293 . . . . 999.99 111.529 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.9 mm -65.16 -46.38 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.491 -0.322 . . . . 322.08 111.04 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -62.99 -43.61 98.31 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.269 -0.423 . . . . 443.19 111.783 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.26 97.0 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.459 -0.337 . . . . 427.97 111.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.66 -42.62 50.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.028 0.442 . . . . 552.67 111.012 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.89 -14.69 64.56 Favored Glycine 0 CA--C 1.518 0.234 0 CA-C-N 115.845 -0.616 . . . . 282.78 112.431 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -75.57 139.06 41.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.596 0.236 . . . . 999.99 110.85 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 68.7 p -75.36 139.4 71.7 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.747 -0.206 . . . . 423.41 110.653 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.47 142.56 33.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.423 2.082 . . . . 262.13 112.924 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.421 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 18.6 m -102.87 171.42 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.503 . . . . 322.52 111.095 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 76.8 t -60.78 -42.52 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.305 -0.407 . . . . 195.73 110.52 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.31 96.02 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.957 -0.64 . . . . 116.64 112.234 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.826 0.346 . . . . 397.23 110.178 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.421 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 28.2 m-85 -62.96 -41.78 99.63 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.935 -0.575 . . . . 273.3 111.226 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 77.2 p -68.03 -36.37 79.82 Favored 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 111.847 0.314 . . . . 391.43 111.847 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.9 -41.66 95.41 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.032 0.444 . . . . 999.99 110.15 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -69.37 -39.02 78.29 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.629 -0.714 . . . . 292.18 110.205 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -36.73 93.41 Favored Glycine 0 C--N 1.333 0.365 0 CA-C-N 115.176 -0.92 . . . . 65.97 113.175 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.9 85.08 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.427 0.156 . . . . 184.99 111.209 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.97 -40.66 96.35 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.969 0.414 . . . . 381.14 110.252 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -64.53 -43.58 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.828 -0.624 . . . . 354.06 110.545 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.401 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . -64.44 -22.45 67.62 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.719 -0.673 . . . . 88.8 113.95 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.2 -14.2 58.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.034 0.417 . . . . 999.99 111.489 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.75 115.38 29.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.632 0.253 . . . . 999.99 110.866 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.492 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 43.4 pt -129.78 147.44 33.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.996 0.427 . . . . 458.46 111.241 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -148.08 34.98 0.82 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.0 -0.546 . . . . 388.05 110.976 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.9 mmm -61.95 -39.5 92.32 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.189 -0.46 . . . . 538.07 111.382 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.7 88.98 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.174 -0.466 . . . . 282.7 111.104 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -68.94 -30.94 69.49 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.756 -0.656 . . . . 999.99 111.666 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.451 ' O ' HD21 ' A' ' 105' ' ' LEU . 88.8 t80 -58.78 -49.65 76.88 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.751 0.31 . . . . 504.74 110.833 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -66.87 -37.14 83.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.462 -0.335 . . . . 999.99 111.309 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.97 -44.46 97.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.415 -0.357 . . . . 558.87 110.385 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.18 -41.65 99.24 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.029 -0.532 . . . . 412.73 111.114 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.451 HD21 ' O ' ' A' ' 101' ' ' PHE . 3.8 mm? -66.05 -41.49 90.74 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.07 -0.514 . . . . 665.66 110.754 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -62.55 -41.12 98.69 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.119 -0.491 . . . . 999.99 110.65 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.56 -40.2 78.36 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.975 -0.557 . . . . 746.24 111.314 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.2 -4.42 59.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.313 -0.403 . . . . 999.99 111.04 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 57.64 39.85 27.15 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.851 -0.613 . . . . 848.93 111.428 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 98.7 mmm -108.36 114.25 27.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.424 -0.353 . . . . 999.99 111.321 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.1 mt -94.44 118.99 66.96 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 586.78 109.831 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.72 126.72 12.31 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.019 1.812 . . . . 310.73 113.053 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -87.11 156.41 19.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.768 -0.651 . . . . 866.09 110.774 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.423 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 75.4 t80 -67.27 125.92 27.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.025 -0.361 . . . . 999.99 110.025 178.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.3 mt -98.62 138.08 20.71 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.535 -0.302 . . . . 579.24 111.363 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.84 -23.17 55.48 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.655 2.237 . . . . 684.25 111.861 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -63.84 -30.17 71.29 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.559 -0.746 . . . . 662.15 110.822 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.6 mtt -60.13 -39.16 85.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.962 -0.563 . . . . 999.99 110.66 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -61.09 -40.87 95.35 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.215 -0.448 . . . . 675.31 110.69 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.27 -41.11 97.07 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.137 -0.483 . . . . 900.95 111.069 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.98 -44.53 99.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.351 -0.386 . . . . 500.83 110.816 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.54 -39.63 94.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.392 -0.367 . . . . 834.99 111.632 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -68.01 -33.43 74.6 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.206 0.447 . . . . 999.99 112.206 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -83.33 130.45 35.06 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.08 0.4 . . . . 599.62 112.08 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -53.6 145.66 28.41 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 115.731 -0.668 . . . . 999.99 111.117 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -27.47 84.92 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.609 2.206 . . . . 214.74 112.618 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.437 ' HA ' ' CG1' ' A' ' 17' ' ' VAL . . . -71.07 -19.75 62.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 248.66 111.29 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -103.5 12.69 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.334 -0.394 . . . . 360.37 111.194 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.4 t -98.82 110.43 57.33 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.834 0.35 . . . . 334.76 110.696 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.94 166.59 26.58 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.091 2.527 . . . . 351.83 112.957 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.37 136.33 42.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.047 -0.723 . . . . 410.42 109.047 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -115.67 131.11 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.875 0.369 . . . . 999.99 110.191 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -76.53 158.58 31.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.304 0.573 . . . . 551.94 112.21 -178.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 74.3 mmm . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.264 -0.874 . . . . 965.93 111.526 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 112.731 0.641 . . . . 999.99 112.731 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m -118.96 13.7 13.11 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.488 0.551 . . . . 999.99 112.488 -178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.6 38.91 2.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.911 0.386 . . . . 999.99 111.491 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.8 m80 57.49 -125.78 1.72 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.563 -0.744 . . . . 999.99 111.751 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -108.53 13.63 25.2 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.705 0.261 . . . . 999.99 111.705 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.8 t -100.58 115.43 42.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.086 0.47 . . . . 521.04 110.456 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -89.82 119.61 69.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.948 -0.569 . . . . 999.99 110.217 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.99 137.76 82.54 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.537 2.158 . . . . 546.56 112.386 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -106.81 -67.1 0.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 999.99 111.601 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -105.43 4.27 30.5 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.024 0.379 . . . . 999.99 112.024 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.64 125.25 22.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.58 -0.282 . . . . 999.99 110.957 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -99.53 112.02 24.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.339 . . . . 280.85 110.632 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -61.89 -39.67 92.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.795 -0.639 . . . . 999.99 111.354 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.81 80.03 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.367 -0.379 . . . . 200.79 111.983 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -64.09 -36.06 82.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.414 -0.357 . . . . 518.33 110.123 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 79.2 mm-40 -64.87 -40.39 95.04 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.921 -0.581 . . . . 524.44 110.078 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.4 -47.65 92.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 115.654 -0.703 . . . . 407.88 111.631 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -40.67 97.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 136.03 111.049 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -65.57 -41.74 92.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.903 -0.59 . . . . 505.3 111.615 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.465 ' O ' HG12 ' A' ' 24' ' ' ILE . 57.1 mtmt -60.24 -38.64 84.06 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.589 -0.278 . . . . 703.51 111.488 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.4 t -63.39 -43.68 98.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.635 0.255 . . . . 324.41 110.349 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -65.7 -40.39 92.23 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.365 -0.38 . . . . 685.46 110.708 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.58 HG23 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -64.85 -42.41 94.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.94 -0.573 . . . . 238.49 110.915 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.586 HD13 ' SD ' ' A' ' 58' ' ' MET . 26.9 mm -60.07 -42.79 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.069 -0.514 . . . . 509.15 111.328 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.29 -42.97 96.6 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 111.559 0.207 . . . . 183.06 111.559 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.98 -44.3 96.15 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.744 -0.741 . . . . 63.82 112.848 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -73.03 -20.41 61.0 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.77 0.285 . . . . 351.91 111.77 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -75.63 -39.54 57.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.041 -0.355 . . . . 145.09 110.041 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.523 ' O ' HG21 ' A' ' 32' ' ' VAL . 27.5 mmm180 -63.95 -42.0 97.43 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.328 -0.619 . . . . 999.99 109.328 177.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.477 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -64.53 -39.78 97.1 Favored Glycine 0 CA--C 1.52 0.374 0 CA-C-N 115.551 -0.749 . . . . 82.9 112.282 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.419 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 66.5 tp -59.19 -46.3 88.78 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.181 0.437 . . . . 392.81 112.181 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.523 HG21 ' O ' ' A' ' 29' ' ' ARG . 35.3 m -67.57 -27.08 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 120.835 -0.346 . . . . 455.7 111.883 -179.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.4 ' O ' HG21 ' A' ' 37' ' ' VAL . 98.2 mttt -63.86 -40.71 97.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.826 0.346 . . . . 756.66 110.937 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.477 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 2.7 m-90 -78.4 -31.77 48.44 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.773 0.321 . . . . 999.99 111.184 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 91.7 mt -63.02 -39.81 95.88 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.2 -0.454 . . . . 373.99 111.681 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -71.04 -19.31 62.51 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.886 0.328 . . . . 811.35 111.886 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 33' ' ' LYS . 72.3 t -85.84 -44.88 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.734 0.302 . . . . 461.27 111.767 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -100.46 9.62 42.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.758 0.313 . . . . 575.93 111.547 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.25 -19.63 70.53 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.127 -0.488 . . . . 226.53 114.199 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 52.0 ptt85 -64.15 -34.42 78.02 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.177 0.488 . . . . 999.99 112.226 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 58.5 p -114.05 -0.13 14.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.855 0.359 . . . . 432.8 111.79 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -72.31 124.95 26.17 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 844.62 111.836 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.9 m -77.82 158.91 29.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 316.62 110.705 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -60.67 -43.35 97.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.871 0.367 . . . . 291.13 111.203 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 67.3 t -66.62 -41.65 88.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.096 -0.502 . . . . 467.63 110.824 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.424 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 97.1 mt-30 -62.95 -39.54 94.96 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.967 -0.56 . . . . 430.34 111.511 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.05 -47.32 86.37 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.627 0.251 . . . . 667.57 111.105 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -65.21 -39.55 92.94 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.848 0.356 . . . . 527.8 110.858 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.92 86.55 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.838 -0.619 . . . . 169.13 111.363 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.0 mt -61.31 -36.42 80.06 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.042 -0.527 . . . . 409.47 112.244 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -59.54 -41.17 89.45 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.676 -0.49 . . . . 686.82 109.676 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -67.26 -41.44 85.54 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.864 -0.607 . . . . 213.85 110.039 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.79 -42.94 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.97 -0.559 . . . . 289.44 110.502 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -60.07 -42.78 95.29 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.078 -0.51 . . . . 358.19 110.539 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -63.32 -42.67 99.0 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.328 -0.396 . . . . 999.99 110.567 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -63.95 -43.08 96.88 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.138 0.494 . . . . 999.99 110.242 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -60.32 -47.35 86.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.335 -0.848 . . . . 212.58 110.51 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.586 ' SD ' HD13 ' A' ' 24' ' ' ILE . 1.2 ttp -60.0 -44.16 94.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.666 -0.697 . . . . 262.65 110.851 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.62 -41.51 99.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.113 -0.494 . . . . 684.75 110.976 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.0 m -62.5 -47.06 85.6 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.287 -0.415 . . . . 450.86 111.231 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -64.37 -47.07 80.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.041 -0.527 . . . . 587.54 110.75 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -62.82 -47.73 82.14 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.345 0.498 . . . . 785.5 112.345 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.79 78.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.784 0.661 . . . . 290.18 112.784 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.99 -50.36 74.38 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 121.223 -0.191 . . . . 676.15 111.341 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -73.02 -41.06 64.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.731 0.3 . . . . 824.3 111.209 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.4 tmm? -54.71 -47.32 73.87 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.709 -0.678 . . . . 839.61 112.327 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.3 mt -61.35 -41.09 96.49 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 111.928 0.344 . . . . 667.86 111.928 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -62.51 -47.9 81.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 999.99 111.494 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.6 tt -78.47 -32.19 16.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.621 0.6 . . . . 648.32 112.621 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -60.95 -41.5 96.42 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.63 0.252 . . . . 555.82 111.225 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -60.68 -45.98 92.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 912.86 110.254 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.17 -43.03 93.02 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.907 -0.588 . . . . 999.99 111.474 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.34 -46.36 95.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-O 120.785 0.326 . . . . 322.08 111.394 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.45 -45.1 94.62 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.168 -0.469 . . . . 443.19 111.27 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.3 95.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.438 -0.346 . . . . 427.97 111.81 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.48 -38.48 81.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.557 -0.292 . . . . 552.67 111.502 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.22 6.92 70.64 Favored Glycine 0 CA--C 1.518 0.259 0 C-N-CA 120.772 -0.728 . . . . 282.78 112.465 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -74.04 151.23 40.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.846 0.355 . . . . 999.99 110.981 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.7 p -114.91 95.08 40.4 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 423.41 111.238 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -72.31 155.79 55.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.731 2.287 . . . . 262.13 112.66 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.5 m -100.3 175.49 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 322.52 111.445 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.0 t -60.19 -40.88 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.147 -0.479 . . . . 195.73 111.193 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.4 -39.69 95.13 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.842 -0.694 . . . . 116.64 112.475 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.31 -40.18 95.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.022 0.439 . . . . 397.23 110.347 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -68.47 -39.19 81.48 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.68 -0.691 . . . . 273.3 111.838 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.9 p -66.42 -29.66 69.85 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.835 0.309 . . . . 391.43 111.835 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -63.57 -42.14 98.35 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.01 0.433 . . . . 999.99 110.056 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.26 -41.0 74.05 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.812 -0.631 . . . . 292.18 110.493 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.09 -40.4 99.17 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.417 -0.811 . . . . 65.97 112.95 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.57 -41.97 98.16 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.432 0.158 . . . . 184.99 111.301 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.93 -41.86 97.51 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.936 0.398 . . . . 381.14 110.55 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 92.8 mt -65.27 -42.9 95.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.768 -0.651 . . . . 354.06 110.912 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.32 -20.92 65.88 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 116.019 -0.537 . . . . 88.8 113.544 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 95.7 mtt-85 -79.44 -17.54 54.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.916 0.358 . . . . 999.99 111.42 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -108.71 110.93 22.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.885 0.374 . . . . 999.99 110.88 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.8 mt -129.39 125.55 62.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.831 -0.433 . . . . 458.46 109.831 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -122.46 51.56 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.976 0.417 . . . . 388.05 110.999 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.4 ptm -91.96 -9.73 41.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.123 -0.49 . . . . 538.07 111.837 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.47 95.91 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.837 0.351 . . . . 282.7 111.753 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -70.06 -28.24 65.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.465 . . . . 999.99 111.247 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -58.2 -46.57 85.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.339 -0.391 . . . . 504.74 111.217 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.608 0.242 . . . . 999.99 111.11 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.5 -45.3 69.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.349 -0.387 . . . . 558.87 110.908 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.17 96.07 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.98 -0.554 . . . . 412.73 111.816 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.38 -47.89 84.13 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.421 -0.354 . . . . 665.66 110.83 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -64.27 -40.25 95.61 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.272 -0.422 . . . . 999.99 111.102 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.09 -39.05 80.99 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.001 -0.545 . . . . 746.24 112.16 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -83.0 -11.94 57.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 111.66 0.244 . . . . 999.99 111.66 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.8 t30 52.56 48.64 22.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.027 0.441 . . . . 848.93 111.391 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 19.2 mmt -122.98 102.67 8.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.369 -0.378 . . . . 999.99 110.84 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.2 mt -93.93 117.57 67.21 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.492 -0.322 . . . . 586.78 110.326 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.36 149.48 50.78 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.439 2.093 . . . . 310.73 112.846 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -84.59 147.16 27.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 866.09 110.227 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -66.77 123.04 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 999.99 110.689 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 85.6 mt -98.89 120.73 57.97 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.083 -0.508 . . . . 579.24 111.447 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.67 -28.45 81.62 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.025 2.484 . . . . 684.25 112.37 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.49 -29.0 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.704 -0.68 . . . . 662.15 111.709 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 66.6 mtt -60.01 -39.21 85.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.568 -0.287 . . . . 999.99 110.758 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.41 -40.72 95.42 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.176 -0.465 . . . . 675.31 110.936 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -62.12 -44.38 96.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.174 -0.466 . . . . 900.95 110.966 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.51 -45.09 99.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.353 -0.385 . . . . 500.83 111.11 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -63.09 -40.89 98.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.251 -0.431 . . . . 834.99 112.007 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -66.35 -33.71 76.33 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.383 0.512 . . . . 999.99 112.383 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.8 mtm -80.25 136.98 36.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.789 0.328 . . . . 599.62 111.665 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.487 ' O ' HG22 ' A' ' 129' ' ' VAL . 77.3 mtp85 -53.4 144.12 32.9 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 115.815 -0.63 . . . . 999.99 111.165 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -52.89 -33.95 63.89 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.233 2.622 . . . . 214.74 113.061 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.79 -36.37 78.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 248.66 111.809 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.45 -0.51 57.63 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.972 0.36 . . . . 360.37 111.972 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 125' ' ' ARG . 62.9 t -91.7 114.61 62.48 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.705 0.288 . . . . 334.76 111.022 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.04 157.9 50.3 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.653 2.235 . . . . 351.83 112.352 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 m -120.61 155.89 23.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.299 -0.41 . . . . 410.42 110.761 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -98.26 119.59 37.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.025 0.441 . . . . 999.99 111.381 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -84.37 155.69 22.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.767 -0.651 . . . . 551.94 109.911 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.261 -0.876 . . . . 965.93 111.051 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 ttt-85 . . . . . 0 N--CA 1.464 0.24 0 N-CA-C 110.004 -0.369 . . . . 999.99 110.004 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 m -84.11 74.34 10.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.891 0.377 . . . . 999.99 110.365 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 5.8 t-105 -108.15 -178.38 3.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 999.99 110.614 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.464 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 11.3 t-160 -66.92 135.99 54.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.324 -0.398 . . . . 999.99 110.354 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -105.74 8.15 32.81 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 111.805 0.298 . . . . 999.99 111.805 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.464 ' HB ' ' CE1' ' A' ' 4' ' ' HIS . 65.2 t -113.2 121.9 66.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 521.04 110.413 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.99 156.07 72.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.424 . . . . 999.99 110.986 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.32 151.37 65.84 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.464 2.109 . . . . 546.56 112.323 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.5 ' HG3' ' CD1' ' A' ' 10' ' ' PHE . 22.5 tptm -104.0 123.57 47.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 999.99 110.305 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.5 ' CD1' ' HG3' ' A' ' 9' ' ' LYS . 75.3 m-85 59.01 39.4 23.53 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.575 0.547 . . . . 999.99 111.683 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -56.99 120.02 7.26 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.869 0.366 . . . . 999.99 111.278 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -114.3 123.35 49.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.322 -0.399 . . . . 280.85 110.154 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -61.87 -39.48 92.06 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.399 -0.364 . . . . 999.99 111.213 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.75 -38.41 81.66 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.144 -0.48 . . . . 200.79 111.616 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -71.25 -25.48 62.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 518.33 111.438 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.08 -40.11 96.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.276 -0.42 . . . . 524.44 112.115 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -72.82 -27.19 24.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 120.782 -0.367 . . . . 407.88 111.633 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.87 93.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.326 0.584 . . . . 136.03 109.631 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.8 mt -64.08 -41.16 97.41 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.123 -0.944 . . . . 505.3 111.206 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.41 -40.15 93.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.992 -0.549 . . . . 703.51 111.788 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.404 ' O ' HG22 ' A' ' 24' ' ' ILE . 78.6 t -64.51 -45.95 94.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.582 -0.281 . . . . 324.41 111.51 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.86 -41.15 75.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.958 0.355 . . . . 685.46 111.958 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.503 HG22 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -66.95 -44.8 88.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.404 -0.362 . . . . 238.49 111.933 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.404 HG22 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -63.18 -32.74 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 111.964 0.357 . . . . 509.15 111.964 -178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.66 -45.95 92.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.407 -0.36 . . . . 183.06 111.457 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.18 -41.94 91.73 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.753 -0.737 . . . . 63.82 112.617 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 43.8 m-85 -70.27 -28.05 64.91 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.74 0.274 . . . . 351.91 111.74 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' O ' HG21 ' A' ' 32' ' ' VAL . 35.3 t70 -76.72 -40.99 46.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.436 -0.209 . . . . 145.09 110.436 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -62.85 -44.56 95.81 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.622 -0.51 . . . . 999.99 109.622 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -38.64 96.65 Favored Glycine 0 C--N 1.335 0.489 0 CA-C-N 115.464 -0.789 . . . . 82.9 112.226 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 tp -64.09 -42.96 96.73 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.736 0.303 . . . . 392.81 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 28' ' ' ASP . 63.5 t -61.51 -45.26 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.983 -0.553 . . . . 455.7 110.598 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -62.5 -40.59 97.2 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.838 0.351 . . . . 756.66 110.473 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -63.13 -43.95 96.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.995 -0.548 . . . . 999.99 110.033 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.46 -37.93 87.85 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.698 -0.683 . . . . 373.99 111.214 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.71 -37.74 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.688 0.28 . . . . 811.35 111.579 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.6 t -87.33 -50.66 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 113.525 0.935 . . . . 461.27 113.525 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.492 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.9 m80 -101.9 -27.56 12.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.022 0.749 . . . . 575.93 113.022 -177.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -72.08 -11.7 75.0 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.07 -0.586 . . . . 226.53 113.401 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -60.85 -39.92 90.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.819 0.303 . . . . 999.99 111.819 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 76.6 p -97.85 -8.13 28.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.246 0.461 . . . . 432.8 112.246 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 97.2 mt -73.11 150.7 42.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.064 0.459 . . . . 844.62 111.819 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 m -72.72 161.86 30.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.753 -0.658 . . . . 316.62 110.642 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -59.48 -40.1 85.86 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.109 -0.496 . . . . 291.13 111.12 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.425 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 55.8 t -65.15 -43.46 95.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.415 . . . . 467.63 110.852 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.88 -39.96 94.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.269 -0.423 . . . . 430.34 111.054 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.32 -47.18 87.13 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.277 -0.419 . . . . 667.57 110.795 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.41 -38.61 90.46 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.277 -0.419 . . . . 527.8 111.399 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.53 86.07 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.126 -0.488 . . . . 169.13 111.608 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -60.11 -30.67 69.42 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.171 -0.468 . . . . 409.47 111.99 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -62.35 -41.2 98.4 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.631 0.253 . . . . 686.82 110.769 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -66.58 -41.01 89.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.112 0.482 . . . . 213.85 110.122 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.477 HG12 ' CE2' ' A' ' 101' ' ' PHE . 62.6 t -60.86 -41.31 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 115.418 -0.81 . . . . 289.44 110.502 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.79 -42.15 88.35 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.928 -0.578 . . . . 358.19 110.506 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -63.28 -44.57 94.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.511 -0.313 . . . . 999.99 110.975 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.7 mtm180 -65.27 -42.41 93.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.989 0.423 . . . . 999.99 111.168 179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -62.05 -44.43 96.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.535 -0.757 . . . . 212.58 110.499 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.503 ' SD ' HG22 ' A' ' 23' ' ' ILE . 9.0 ttp -59.4 -40.88 88.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.864 -0.607 . . . . 262.65 110.744 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.19 -42.54 99.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.169 -0.469 . . . . 684.75 111.365 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.4 p -71.39 -37.87 71.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.806 0.336 . . . . 450.86 111.116 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -63.99 -44.86 91.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.034 -0.53 . . . . 587.54 109.683 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 38.6 t-105 -61.74 -45.47 93.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.367 -0.833 . . . . 785.5 111.918 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.41 77.99 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.511 0.56 . . . . 290.18 112.511 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -62.13 -41.49 98.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.722 0.267 . . . . 676.15 111.722 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -82.52 -33.73 28.15 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.623 -0.262 . . . . 824.3 111.527 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.2 ttp -53.17 -43.93 67.46 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.988 -0.551 . . . . 839.61 112.02 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 98.1 mt -60.87 -41.41 95.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.295 -0.411 . . . . 667.86 111.339 -178.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -69.03 -39.74 79.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.473 -0.331 . . . . 999.99 111.299 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.95 -45.34 99.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.038 -0.528 . . . . 648.32 111.349 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -62.33 -37.13 84.45 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.235 -0.439 . . . . 555.82 112.103 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -60.89 -42.89 98.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.631 0.253 . . . . 912.86 110.931 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -67.41 -42.46 83.23 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.358 -0.383 . . . . 999.99 111.419 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.93 -47.04 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.307 -0.406 . . . . 322.08 111.168 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -63.05 -43.95 97.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.161 -0.472 . . . . 443.19 111.452 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.47 -40.77 98.0 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.471 -0.331 . . . . 427.97 111.859 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.1 mt -70.26 -41.34 73.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.953 0.406 . . . . 552.67 111.278 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.52 -10.61 71.13 Favored Glycine 0 CA--C 1.52 0.36 0 CA-C-N 116.05 -0.523 . . . . 282.78 112.779 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.5 mpt_? -75.22 149.25 38.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.672 0.273 . . . . 999.99 111.347 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 74.9 p -72.24 138.48 81.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.387 -0.37 . . . . 423.41 110.585 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.0 136.99 23.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.291 1.994 . . . . 262.13 112.748 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.7 m -104.37 155.14 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 322.52 111.243 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 79.6 t -63.58 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.17 -0.468 . . . . 195.73 111.169 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.63 97.7 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.745 -0.741 . . . . 116.64 112.608 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.38 -41.14 96.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.156 0.503 . . . . 397.23 109.807 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -63.0 -42.41 99.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.316 -0.856 . . . . 273.3 111.324 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -67.74 -36.2 80.13 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.9 -0.32 . . . . 391.43 110.932 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -62.83 -46.48 87.75 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.003 0.43 . . . . 999.99 110.01 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.27 -41.23 94.42 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.747 -0.661 . . . . 292.18 110.792 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.06 -41.07 99.67 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-N 115.97 -0.559 . . . . 65.97 112.413 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.455 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -62.26 -40.13 95.19 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.605 0.24 . . . . 184.99 110.95 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -66.98 -40.8 87.49 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.063 0.459 . . . . 381.14 110.467 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.5 mt -64.71 -41.5 92.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.562 -0.745 . . . . 354.06 111.031 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.09 -11.77 59.25 Favored Glycine 0 CA--C 1.52 0.384 0 CA-C-N 115.969 -0.559 . . . . 88.8 113.694 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 79.5 mtp85 -80.19 -10.96 59.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.069 0.434 . . . . 999.99 111.239 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.2 mmt85 -108.42 129.3 55.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.924 0.392 . . . . 999.99 110.925 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.83 -76.87 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.438 . . . . 458.46 111.093 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.1 t0 55.79 49.01 17.01 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.999 0.428 . . . . 388.05 111.649 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.6 mtm -86.52 -2.34 58.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.244 -0.435 . . . . 538.07 111.531 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.15 89.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.172 -0.467 . . . . 282.7 111.919 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -62.89 -39.02 93.2 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.257 -0.429 . . . . 999.99 111.868 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.477 ' CE2' HG12 ' A' ' 53' ' ' VAL . 86.7 t80 -58.97 -47.19 86.01 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.821 0.343 . . . . 504.74 110.736 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -59.75 -47.68 84.69 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.002 -0.544 . . . . 999.99 110.733 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.42 -39.21 89.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.039 -0.528 . . . . 558.87 110.931 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.41 95.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.152 -0.476 . . . . 412.73 111.317 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.24 -43.02 99.78 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.606 -0.27 . . . . 665.66 110.692 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.7 -44.39 93.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.226 -0.443 . . . . 999.99 110.721 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.45 -43.26 88.75 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.777 -0.647 . . . . 746.24 111.769 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -87.91 -5.16 58.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.385 -0.371 . . . . 999.99 111.647 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.16 43.68 26.37 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.935 0.494 . . . . 848.93 111.187 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.1 103.75 13.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.318 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -94.59 117.81 66.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.007 -0.542 . . . . 586.78 110.334 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.43 138.68 33.15 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.29 1.993 . . . . 310.73 112.887 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -86.27 144.27 27.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.935 -0.575 . . . . 866.09 110.957 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.425 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 47.0 t80 -68.95 99.17 1.03 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.728 0.299 . . . . 999.99 111.214 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.9 mt -98.74 123.34 50.06 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.419 -0.355 . . . . 579.24 110.975 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.81 -34.27 84.43 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.165 2.576 . . . . 684.25 112.479 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.98 -43.87 94.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.901 -0.59 . . . . 662.15 111.334 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.77 -41.14 90.4 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.474 -0.33 . . . . 999.99 110.535 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -61.77 -42.1 98.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.958 -0.565 . . . . 675.31 110.327 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.48 -43.42 98.86 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.003 -0.544 . . . . 900.95 111.452 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.91 -46.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.76 0.314 . . . . 500.83 111.001 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -62.5 -40.8 97.89 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.098 -0.501 . . . . 834.99 111.378 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 67.4 ttp85 -64.86 -34.84 79.32 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.188 -0.46 . . . . 999.99 111.826 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.9 mtp -72.89 134.49 44.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.949 0.404 . . . . 599.62 111.753 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -53.85 145.05 33.57 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.517 -0.765 . . . . 999.99 111.3 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.57 -38.5 83.88 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.969 2.446 . . . . 214.74 112.942 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.45 75.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.572 . . . . 248.66 112.114 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -90.03 -15.0 32.71 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.205 0.817 . . . . 360.37 113.205 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 9.0 p -105.03 130.95 22.26 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 120.501 -0.479 . . . . 334.76 111.441 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -61.3 147.24 96.08 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.816 2.344 . . . . 351.83 112.491 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.2 m -126.3 152.31 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.211 -0.45 . . . . 410.42 110.394 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -118.84 127.7 53.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 999.99 110.992 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -84.49 80.54 9.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.037 -0.529 . . . . 551.94 110.478 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.6 mtp . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.1 -0.953 . . . . 965.93 111.106 -179.646 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 . . . . . 0 N--CA 1.463 0.214 0 CA-C-O 121.034 0.445 . . . . 999.99 111.07 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.9 m -92.42 45.28 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.125 -0.489 . . . . 999.99 112.025 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.3 t90 -62.2 -45.9 91.32 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.099 0.476 . . . . 999.99 110.461 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -84.12 64.53 8.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.098 -0.501 . . . . 999.99 110.867 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -123.23 -70.04 0.79 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 999.99 110.02 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.4 t -123.47 123.06 66.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 521.04 109.83 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.07 149.18 65.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 110.411 -0.218 . . . . 999.99 110.411 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.82 136.04 37.34 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.085 1.857 . . . . 546.56 112.367 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -120.63 -38.81 2.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.586 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -103.1 2.39 34.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.791 0.293 . . . . 999.99 111.791 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.1 tp -57.91 124.12 18.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.754 0.312 . . . . 999.99 110.743 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -113.26 120.1 40.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 280.85 110.495 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -62.1 -37.95 87.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 999.99 111.068 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.24 82.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.191 -0.458 . . . . 200.79 111.587 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -77.74 -20.39 53.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 518.33 110.976 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.39 -42.56 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 524.44 111.612 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.02 -32.55 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 120.961 -0.296 . . . . 407.88 111.685 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.57 -44.32 96.63 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.114 0.483 . . . . 136.03 110.252 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 90.9 mt -69.51 -38.2 77.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.475 -0.784 . . . . 505.3 111.329 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -59.03 -41.92 88.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.548 -0.751 . . . . 703.51 111.794 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.01 -44.69 99.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.527 0.204 . . . . 324.41 111.116 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.88 -40.78 91.92 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.82 0.343 . . . . 685.46 111.148 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.72 -42.78 95.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.913 -0.585 . . . . 238.49 111.503 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 86.8 mt -60.21 -42.5 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.391 -0.368 . . . . 509.15 111.621 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.87 94.89 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.079 -0.248 . . . . 183.06 111.42 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.69 94.16 Favored Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.876 -0.678 . . . . 63.82 112.578 178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -73.12 -18.34 61.3 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 122.762 0.425 . . . . 351.91 112.009 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.04 -38.96 61.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.787 0.291 . . . . 145.09 111.787 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -66.19 -32.3 73.65 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 120.516 -0.474 . . . . 999.99 110.11 179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.96 -39.16 97.72 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 115.683 -0.69 . . . . 82.9 112.138 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.77 -39.28 93.87 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.55 0.214 . . . . 392.81 110.876 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.492 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 69.6 t -61.03 -46.73 96.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.16 -0.473 . . . . 455.7 111.095 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -64.23 -41.5 96.97 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.908 0.385 . . . . 756.66 110.979 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.552 ' O ' HG12 ' A' ' 37' ' ' VAL . 76.5 t90 -65.46 -43.33 90.7 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.404 0.621 . . . . 999.99 110.39 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.46 -33.19 73.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.187 -0.915 . . . . 373.99 112.487 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.492 ' HG3' ' O ' ' A' ' 32' ' ' VAL . 99.4 mtt180 -58.24 -28.49 64.95 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.38 0.881 . . . . 811.35 113.38 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.552 HG12 ' O ' ' A' ' 34' ' ' TRP . 8.6 p -84.5 -26.33 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.667 -0.413 . . . . 461.27 112.022 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -111.2 15.28 21.58 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.65 0.262 . . . . 575.93 111.257 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -39.81 97.81 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.066 -0.515 . . . . 226.53 114.293 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -65.12 -23.23 67.08 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.606 0.595 . . . . 999.99 112.606 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.6 p -112.83 11.65 19.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.046 0.387 . . . . 432.8 112.046 -179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.6 tp -71.9 122.49 20.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 844.62 112.041 -179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 71.1 m -80.53 159.21 25.58 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.963 -0.562 . . . . 316.62 110.033 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -61.73 -43.77 98.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.659 0.266 . . . . 291.13 111.639 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -73.22 -31.22 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 111.7 0.259 . . . . 467.63 111.7 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -62.8 -38.54 91.09 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.784 0.29 . . . . 430.34 111.784 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -59.77 -46.26 89.74 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.732 0.301 . . . . 667.57 110.388 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.42 -39.0 91.6 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.221 -0.445 . . . . 527.8 110.396 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.53 -36.54 80.84 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.549 -0.75 . . . . 169.13 111.849 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.21 -36.68 78.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.372 -0.376 . . . . 409.47 111.904 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -61.22 -39.61 90.9 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.471 -0.566 . . . . 686.82 109.471 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.72 -39.84 88.18 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.757 -0.656 . . . . 213.85 109.776 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 63.2 t -60.11 -39.15 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.142 0 CA-C-N 115.741 -0.663 . . . . 289.44 110.461 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -56.88 -47.05 81.37 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.327 -0.397 . . . . 358.19 110.799 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.97 -40.56 91.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.664 -0.244 . . . . 999.99 110.756 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -62.07 -45.49 93.28 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.056 0.455 . . . . 999.99 110.111 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -60.44 -47.04 87.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.571 -0.74 . . . . 212.58 110.157 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -46.9 88.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 262.65 111.474 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -62.85 -43.44 98.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.005 0.372 . . . . 684.75 112.005 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.426 HG22 ' SD ' ' A' ' 134' ' ' MET . 41.3 p -71.57 -40.42 69.95 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.797 0.295 . . . . 450.86 111.797 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.437 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 61.1 t-80 -64.13 -47.56 79.47 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.875 0.369 . . . . 587.54 110.548 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -63.74 -44.15 94.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.747 -0.661 . . . . 785.5 112.081 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.64 83.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.796 0.665 . . . . 290.18 112.796 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -64.62 -40.89 96.29 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.921 0.341 . . . . 676.15 111.921 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.437 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 79.8 m-85 -81.49 -26.78 34.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.757 0.28 . . . . 824.3 111.757 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.5 ttp -52.54 -41.6 63.67 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.051 -0.522 . . . . 839.61 112.072 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.78 -44.61 90.7 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.663 -0.244 . . . . 667.86 111.494 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.6 m0 -67.36 -41.15 85.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 999.99 110.818 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 47.5 mm -67.37 -45.41 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 115.95 -0.568 . . . . 648.32 111.047 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.16 -41.93 97.65 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.949 -0.569 . . . . 555.82 111.47 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -60.18 -45.55 92.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.435 -0.348 . . . . 912.86 110.63 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.62 -42.66 95.36 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.402 -0.363 . . . . 999.99 111.269 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -63.8 -46.92 93.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.813 0.34 . . . . 322.08 111.164 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.43 -40.81 97.77 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.257 -0.429 . . . . 443.19 111.312 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.46 95.92 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.374 -0.375 . . . . 427.97 111.419 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.1 mt -69.77 -40.47 76.05 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.341 -0.39 . . . . 552.67 111.341 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 -8.22 79.59 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.044 -0.598 . . . . 282.78 112.507 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -74.76 153.06 38.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 999.99 111.707 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -108.53 95.96 17.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.008 -0.542 . . . . 423.41 110.651 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.89 147.61 55.96 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.552 2.168 . . . . 262.13 113.282 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -101.07 -175.37 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.615 -0.721 . . . . 322.52 111.142 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.3 t -58.77 -41.97 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.404 -0.362 . . . . 195.73 110.718 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.612 ' O ' HG23 ' A' ' 86' ' ' THR . . . -60.57 -40.62 98.1 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.658 -0.782 . . . . 116.64 112.181 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.15 -40.58 90.7 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 397.23 110.692 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -69.18 -36.26 77.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.705 -0.68 . . . . 273.3 112.174 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.612 HG23 ' O ' ' A' ' 83' ' ' GLY . 0.8 OUTLIER -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.638 0.236 . . . . 391.43 111.638 -179.089 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.21 -46.34 89.35 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.722 -0.473 . . . . 999.99 109.722 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.71 -39.82 84.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.582 -0.735 . . . . 292.18 110.423 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.66 99.2 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 115.717 -0.674 . . . . 65.97 112.436 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.452 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.77 -41.22 97.42 Favored 'General case' 0 C--N 1.335 -0.064 0 CA-C-O 120.745 0.307 . . . . 184.99 110.498 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.48 -40.06 95.46 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.039 -0.528 . . . . 381.14 110.596 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 37.4 mm -63.28 -43.65 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.948 -0.569 . . . . 354.06 110.383 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 -20.61 66.84 Favored Glycine 0 CA--C 1.521 0.457 0 CA-C-N 115.873 -0.603 . . . . 88.8 113.609 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 42.0 mmt180 -79.73 -16.12 56.22 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.939 0.369 . . . . 999.99 111.384 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 -107.7 111.72 24.06 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.015 -0.365 . . . . 999.99 110.015 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -125.44 125.33 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.412 -0.358 . . . . 458.46 110.164 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.6 70.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.986 0.422 . . . . 388.05 110.888 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.82 -29.01 66.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.885 -0.598 . . . . 538.07 110.764 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.03 79.88 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.532 -0.758 . . . . 282.7 111.405 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.44 -46.98 85.45 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.113 -0.494 . . . . 999.99 111.064 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.488 ' CE2' HD12 ' A' ' 105' ' ' LEU . 89.4 t80 -58.27 -48.17 81.29 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.781 0.324 . . . . 504.74 110.728 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.69 -47.96 83.92 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.995 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -62.2 -39.08 91.55 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.055 -0.52 . . . . 558.87 111.609 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.47 94.57 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.384 -0.371 . . . . 412.73 111.265 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.488 HD12 ' CE2' ' A' ' 101' ' ' PHE . 90.2 mt -63.33 -40.83 98.37 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.304 -0.407 . . . . 665.66 110.667 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -64.7 -40.18 94.93 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.008 -0.542 . . . . 999.99 110.903 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.32 -43.36 88.16 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.882 -0.599 . . . . 746.24 111.525 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt -87.19 -6.92 58.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.472 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 56.42 37.24 28.65 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.956 0.502 . . . . 848.93 111.334 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.8 ttp -116.89 117.37 29.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 999.99 111.311 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.75 119.54 65.96 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.051 -0.522 . . . . 586.78 110.224 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.07 138.87 87.91 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.515 2.143 . . . . 310.73 112.33 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -85.49 119.52 25.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.414 -0.357 . . . . 866.09 110.966 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -70.01 89.84 0.62 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.068 -0.514 . . . . 999.99 110.562 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 86.4 mt -97.8 141.93 23.76 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 112.006 0.372 . . . . 579.24 112.006 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.6 -33.04 97.88 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.237 2.625 . . . . 684.25 112.575 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -59.72 -44.54 93.68 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.077 -0.51 . . . . 662.15 111.203 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 65.6 mtt -60.51 -40.2 90.55 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.798 -0.445 . . . . 999.99 109.798 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.94 -40.57 96.0 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.619 -0.718 . . . . 675.31 110.444 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.14 -39.79 94.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.694 -0.685 . . . . 900.95 111.072 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.3 mt -61.09 -43.64 96.67 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.434 -0.348 . . . . 500.83 110.73 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.77 -37.78 83.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.258 -0.428 . . . . 834.99 110.336 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -64.11 -33.39 75.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.64 . . . . 999.99 110.758 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 69.6 mtm -68.47 140.0 55.72 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.462 -0.335 . . . . 599.62 110.956 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG21 ' A' ' 129' ' ' VAL . 55.6 mmm-85 -52.46 137.48 41.09 Favored Pre-proline 0 N--CA 1.465 0.302 0 CA-C-N 115.892 -0.595 . . . . 999.99 111.51 178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -35.13 79.01 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.316 2.677 . . . . 214.74 113.229 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.1 77.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 248.66 112.106 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.75 -1.98 57.83 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.87 0.322 . . . . 360.37 111.87 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 125' ' ' ARG . 68.7 t -98.59 115.75 65.66 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.679 0.276 . . . . 334.76 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.57 156.09 61.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.671 2.247 . . . . 351.83 112.473 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.5 p -106.89 139.78 27.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 410.42 110.448 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -107.87 131.88 54.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.057 0.456 . . . . 999.99 110.879 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -83.95 156.71 22.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.848 -0.614 . . . . 551.94 110.733 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.426 ' SD ' HG22 ' A' ' 60' ' ' THR . 78.2 mmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.425 -0.798 . . . . 965.93 111.045 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 . . . . . 0 N--CA 1.471 0.613 0 CA-C-O 120.644 0.259 . . . . 999.99 111.661 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.3 m -115.7 89.94 3.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.032 0.444 . . . . 999.99 110.872 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.7 m-90 -101.97 21.8 14.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.283 -0.417 . . . . 999.99 110.837 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -89.58 -3.5 58.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 999.99 111.292 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -107.57 -59.3 1.85 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.985 0.422 . . . . 999.99 110.269 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.0 m -131.11 152.15 37.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.928 -0.578 . . . . 521.04 110.234 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.05 149.82 70.61 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.881 0.372 . . . . 999.99 111.376 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.25 161.21 45.15 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.052 2.501 . . . . 546.56 113.076 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.0 mttp 67.42 17.32 10.1 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.428 -0.805 . . . . 999.99 112.258 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -62.28 -50.09 73.08 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.079 0.466 . . . . 999.99 110.378 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.06 139.84 56.43 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.411 -0.813 . . . . 999.99 111.245 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -61.69 129.83 42.95 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.396 -0.365 . . . . 280.85 110.293 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -63.24 -20.34 65.36 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.556 0.576 . . . . 999.99 112.556 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.3 -39.09 81.91 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.75 0.309 . . . . 200.79 111.632 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -68.37 -30.45 69.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 518.33 110.885 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.25 -39.68 94.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 524.44 110.76 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.6 -48.98 86.26 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-N 116.148 -0.478 . . . . 407.88 111.386 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.25 -41.69 99.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.023 -0.535 . . . . 136.03 111.433 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.495 HD22 ' CE2' ' A' ' 85' ' ' TYR . 51.6 tp -66.5 -41.42 88.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 505.3 111.392 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -59.28 -35.24 73.4 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.952 -0.567 . . . . 703.51 112.054 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.17 -44.15 98.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.822 0.344 . . . . 324.41 110.291 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -69.97 -38.57 76.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.961 0.41 . . . . 685.46 110.465 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.427 HG21 HD12 ' A' ' 23' ' ' ILE . 88.8 mt -61.05 -47.09 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.765 0.654 . . . . 238.49 112.765 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 32.9 pt -60.26 -36.22 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 112.775 0.657 . . . . 509.15 112.775 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.91 -46.22 90.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.665 0.269 . . . . 183.06 111.361 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.67 -41.14 89.95 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 121.138 -0.554 . . . . 63.82 112.888 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -73.62 -21.09 60.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.268 . . . . 351.91 111.704 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.468 ' O ' HG21 ' A' ' 32' ' ' VAL . 16.3 t70 -77.12 -40.23 46.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.684 -0.235 . . . . 145.09 110.705 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.07 -42.38 99.65 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.001 0.429 . . . . 999.99 109.954 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.402 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -65.48 -39.59 95.74 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.639 -0.709 . . . . 82.9 111.773 178.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.9 -41.62 98.12 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 115.64 -0.28 . . . . 392.81 110.768 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 28' ' ' ASP . 64.4 t -60.72 -42.77 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.18 -0.464 . . . . 455.7 111.115 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -61.39 -41.56 97.32 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.608 -0.269 . . . . 756.66 111.21 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.402 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 1.8 m-90 -74.24 -37.3 63.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.036 0.446 . . . . 999.99 110.94 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.3 tp -64.31 -41.85 96.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.945 -0.571 . . . . 373.99 112.039 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -66.18 -23.0 66.38 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.192 0.812 . . . . 811.35 113.192 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.1 m -98.21 -20.0 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 112.991 0.737 . . . . 461.27 112.991 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -109.35 -27.41 9.52 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.879 -0.328 . . . . 575.93 111.666 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.95 -26.33 60.65 Favored Glycine 0 C--N 1.331 0.265 0 CA-C-N 115.801 -0.636 . . . . 226.53 114.38 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -66.4 -22.49 66.23 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.558 0.679 . . . . 999.99 111.36 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 66.1 p -112.55 -20.67 11.65 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.234 0.457 . . . . 432.8 112.234 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.1 mt -73.09 147.32 45.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.122 0.487 . . . . 844.62 112.093 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -75.97 163.62 26.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 316.62 109.75 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.3 m -58.88 -42.31 89.2 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.826 0.346 . . . . 291.13 110.893 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 63.2 t -66.09 -42.23 91.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.311 -0.404 . . . . 467.63 110.581 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.25 -40.21 96.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.147 -0.479 . . . . 430.34 111.455 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.14 -41.99 99.39 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.661 0.267 . . . . 667.57 110.83 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.37 -39.25 85.65 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.005 0.431 . . . . 527.8 110.374 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 118' ' ' MET . . . -61.7 -36.16 80.1 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.556 -0.747 . . . . 169.13 111.105 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.78 -38.91 79.57 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.751 -0.659 . . . . 409.47 111.193 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -60.7 -40.52 92.52 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.836 0.35 . . . . 686.82 110.343 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -65.85 -40.65 91.91 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.92 -0.582 . . . . 213.85 109.968 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.512 HG12 ' CE2' ' A' ' 101' ' ' PHE . 55.1 t -60.82 -41.13 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 115.5 -0.773 . . . . 289.44 110.872 179.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -59.13 -42.73 91.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.312 -0.404 . . . . 358.19 110.598 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -65.03 -41.81 94.89 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.824 0.345 . . . . 999.99 110.519 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -63.41 -43.93 96.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.914 -0.585 . . . . 999.99 110.619 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -59.81 -48.34 82.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.704 -0.68 . . . . 212.58 111.039 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -61.16 -44.22 97.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.423 -0.353 . . . . 262.65 111.109 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.3 -43.21 99.34 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.113 0.412 . . . . 684.75 112.113 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.2 p -71.61 -41.16 69.26 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.959 -0.296 . . . . 450.86 111.571 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -63.22 -46.77 85.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.179 0.514 . . . . 587.54 110.179 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -63.83 -38.7 92.09 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.291 -0.868 . . . . 785.5 111.826 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.79 74.65 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.727 0.269 . . . . 290.18 111.727 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -60.87 -44.08 97.53 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.792 0.33 . . . . 676.15 110.302 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -70.6 -36.19 73.39 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.129 -0.487 . . . . 824.3 111.254 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 75.9 mmm -51.7 -35.22 41.93 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.065 -0.516 . . . . 839.61 112.261 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.29 -50.03 75.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.613 0.244 . . . . 667.86 111.168 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -69.45 -40.1 77.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.354 -0.385 . . . . 999.99 111.394 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.7 mm -64.78 -46.05 93.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.987 -0.551 . . . . 648.32 111.51 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.51 -43.09 99.67 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.368 -0.378 . . . . 555.82 111.23 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.59 -41.94 98.3 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.522 -0.308 . . . . 912.86 110.933 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.73 -47.1 85.02 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 999.99 110.83 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.69 -45.92 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.131 -0.486 . . . . 322.08 110.942 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.45 -45.1 94.58 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.227 -0.442 . . . . 443.19 111.684 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.66 98.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.654 -0.248 . . . . 427.97 111.594 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.4 tp -68.13 -45.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.152 0.501 . . . . 552.67 110.592 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.03 -23.02 31.27 Favored Glycine 0 C--N 1.331 0.278 0 CA-C-N 115.708 -0.678 . . . . 282.78 112.789 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -76.54 141.79 41.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.602 0.239 . . . . 999.99 110.932 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.3 p -82.0 134.41 49.71 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.579 -0.282 . . . . 423.41 110.702 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 154.95 46.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.66 2.24 . . . . 262.13 112.745 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -101.72 158.04 4.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.346 -0.388 . . . . 322.52 110.1 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.09 -45.0 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.391 -0.368 . . . . 195.73 111.97 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.457 ' O ' HG23 ' A' ' 86' ' ' THR . . . -61.26 -44.42 98.11 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.633 -0.794 . . . . 116.64 113.553 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.22 -41.62 69.95 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.956 0.378 . . . . 397.23 111.491 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.495 ' CE2' HD22 ' A' ' 19' ' ' LEU . 40.1 t80 -65.23 -39.68 93.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.094 -0.503 . . . . 273.3 111.582 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -60.46 -24.11 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.461 -0.336 . . . . 391.43 111.891 -179.604 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -62.41 -37.16 84.72 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.79 0.329 . . . . 999.99 110.887 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.67 -38.96 89.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.909 -0.587 . . . . 292.18 111.17 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.18 -39.3 96.97 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.916 -0.583 . . . . 65.97 113.101 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.09 98.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.633 0.254 . . . . 184.99 111.078 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.79 -40.09 95.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.116 -0.493 . . . . 381.14 110.85 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.5 mm -65.13 -42.71 95.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.772 -0.649 . . . . 354.06 110.953 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.54 -20.16 65.52 Favored Glycine 0 CA--C 1.52 0.388 0 CA-C-N 116.015 -0.539 . . . . 88.8 113.603 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -78.65 -24.52 45.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.037 0.418 . . . . 999.99 111.849 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.85 112.15 24.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 999.99 111.352 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.5 pt -134.69 153.47 35.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.325 -0.398 . . . . 458.46 110.757 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -147.17 55.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.053 0.454 . . . . 388.05 110.608 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.0 mtm -69.32 -28.81 66.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.78 -0.646 . . . . 538.07 111.711 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.14 -40.16 88.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.286 -0.415 . . . . 282.7 111.717 -179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.15 -41.55 97.14 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.554 -0.293 . . . . 999.99 111.126 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.512 ' CE2' HG12 ' A' ' 53' ' ' VAL . 32.0 t80 -64.11 -43.89 93.94 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.697 -0.483 . . . . 504.74 109.697 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -60.11 -47.45 85.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.555 -0.748 . . . . 999.99 110.413 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -61.39 -40.51 94.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 558.87 110.694 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.04 96.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.094 -0.503 . . . . 412.73 111.37 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.92 -42.94 99.96 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.655 -0.248 . . . . 665.66 110.587 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -64.36 -42.99 95.92 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.029 -0.532 . . . . 999.99 110.932 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -57.97 -43.45 86.48 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.843 -0.617 . . . . 746.24 111.912 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -89.38 -4.91 57.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.547 -0.297 . . . . 999.99 111.47 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.5 t30 56.74 41.11 28.66 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.11 0.564 . . . . 848.93 111.226 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.3 mmm -108.04 101.76 10.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.342 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 76.1 mt -94.48 118.38 66.96 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.134 -0.485 . . . . 586.78 110.119 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.65 135.75 69.43 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.529 2.152 . . . . 310.73 112.754 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.49 143.37 28.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.202 -0.454 . . . . 866.09 110.673 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -68.86 108.05 3.31 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.903 0.382 . . . . 999.99 110.638 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.69 146.51 31.74 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.176 -0.465 . . . . 579.24 111.133 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -57.15 -38.38 95.61 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.886 2.391 . . . . 684.25 112.082 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -62.17 -39.43 92.67 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.64 -0.709 . . . . 662.15 110.871 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' MET . . . . . 0.549 ' O ' HG21 ' A' ' 121' ' ' ILE . 60.1 ttm -58.34 -46.38 86.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.103 -0.499 . . . . 999.99 110.236 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.12 -43.67 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.448 . . . . 675.31 110.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 124' ' ' MET . 96.6 mt-10 -65.14 -42.08 94.16 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.111 0.782 . . . . 900.95 113.111 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.549 HG21 ' O ' ' A' ' 118' ' ' MET . 15.3 tt -64.64 -28.68 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 111.816 0.302 . . . . 500.83 111.816 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -63.48 -35.82 81.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.875 0.369 . . . . 834.99 111.005 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.54 -1.67 57.82 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.862 -0.608 . . . . 999.99 112.239 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.499 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 66.1 mtt -88.18 128.88 35.45 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.719 0.295 . . . . 599.62 111.573 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.515 ' O ' HG21 ' A' ' 129' ' ' VAL . 40.5 mmt180 -53.51 142.52 40.57 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 115.939 -0.573 . . . . 999.99 110.758 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.46 -36.93 71.85 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.101 2.534 . . . . 214.74 113.283 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.17 -35.65 77.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 248.66 111.926 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -91.64 1.22 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.493 0.553 . . . . 360.37 112.493 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.515 HG21 ' O ' ' A' ' 125' ' ' ARG . 62.4 t -90.34 113.02 55.97 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 334.76 110.965 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.67 157.25 40.04 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.812 2.341 . . . . 351.83 112.761 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.75 157.55 30.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.361 -0.381 . . . . 410.42 110.398 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -132.08 145.86 51.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.059 0.457 . . . . 999.99 111.326 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.89 168.05 15.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 551.94 111.031 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.167 -0.92 . . . . 965.93 110.949 179.945 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 . . . . . 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 999.99 110.19 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 m -87.31 -11.06 50.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.512 -0.313 . . . . 999.99 111.807 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.86 102.08 7.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.64 0.257 . . . . 999.99 110.871 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.06 2.07 40.04 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.889 0.329 . . . . 999.99 111.889 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.07 -68.35 0.83 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.769 0.318 . . . . 999.99 111.813 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.05 154.92 41.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 521.04 110.897 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.4 147.32 63.77 Favored Pre-proline 0 C--O 1.234 0.277 0 CA-C-N 116.39 -0.368 . . . . 999.99 110.55 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.82 148.35 40.91 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.763 2.308 . . . . 546.56 113.299 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -73.76 135.32 43.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.808 -0.633 . . . . 999.99 109.652 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -77.85 93.29 4.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.419 . . . . 999.99 110.793 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.68 142.41 45.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.522 -0.763 . . . . 999.99 111.831 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.43 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 64.6 t30 -66.47 132.58 48.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.784 -0.45 . . . . 280.85 109.784 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.07 -40.52 93.99 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.657 -0.247 . . . . 999.99 111.655 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -60.29 -39.82 88.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 200.79 111.521 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -73.21 -28.37 62.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.208 -0.451 . . . . 518.33 111.004 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 12' ' ' ASN . 96.4 mt-10 -63.88 -39.96 95.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.296 0.48 . . . . 524.44 112.296 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 14' ' ' ALA . 34.6 m -69.57 -34.1 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 120.674 -0.41 . . . . 407.88 111.491 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.94 95.05 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.248 0.547 . . . . 136.03 110.277 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HG ' HD12 ' A' ' 23' ' ' ILE . 59.0 tp -69.34 -40.53 77.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.15 -0.932 . . . . 505.3 111.677 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' O ' HG12 ' A' ' 24' ' ' ILE . 65.0 tttm -59.74 -39.48 84.91 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.846 -0.616 . . . . 703.51 112.309 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 17' ' ' VAL . 70.7 t -62.54 -43.7 98.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.396 0.141 . . . . 324.41 111.019 -179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.89 -41.53 97.69 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.721 0.296 . . . . 685.46 110.855 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.405 HD12 ' HG ' ' A' ' 19' ' ' LEU . 97.1 mt -63.3 -44.55 99.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.063 -0.517 . . . . 238.49 110.873 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 20' ' ' LYS . 36.2 mm -60.68 -43.04 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 509.15 111.37 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.49 -42.84 97.14 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.8 -0.182 . . . . 183.06 111.397 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.97 -41.85 98.49 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.88 -0.676 . . . . 63.82 112.761 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -73.6 -23.8 59.97 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.885 0.328 . . . . 351.91 111.885 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -78.54 -30.17 46.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.464 -0.335 . . . . 145.09 111.427 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -62.79 -42.25 99.62 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.85 0.357 . . . . 999.99 110.83 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.96 -26.76 52.45 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.673 -0.775 . . . . 82.9 112.457 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.9 tp -65.55 -43.09 90.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.486 0.184 . . . . 392.81 111.393 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.36 -33.71 65.31 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 C-N-CA 121.015 -0.274 . . . . 455.7 111.336 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.62 -40.61 95.79 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 121.334 0.588 . . . . 756.66 109.701 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -64.91 -41.75 95.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.168 -0.923 . . . . 999.99 109.588 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.86 -37.04 83.01 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.228 -0.896 . . . . 373.99 111.146 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -62.43 -37.13 84.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.615 0.245 . . . . 811.35 111.42 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.86 -50.06 14.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 113.424 0.898 . . . . 461.27 113.424 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -107.51 -29.74 9.03 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.132 0.79 . . . . 575.93 113.132 -177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -69.19 -13.01 66.65 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.093 -0.575 . . . . 226.53 113.82 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -64.09 -22.04 66.77 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.87 0.335 . . . . 999.99 111.708 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.0 p -105.88 -15.35 14.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.953 0.406 . . . . 432.8 111.525 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -73.63 148.76 42.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 844.62 111.546 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -76.97 167.21 22.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.995 -0.548 . . . . 316.62 110.57 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -64.7 -32.07 73.58 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.987 0.366 . . . . 291.13 111.987 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -69.03 -39.77 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.958 0.408 . . . . 467.63 110.198 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.527 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 90.1 mt-30 -64.99 -41.32 95.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.829 -0.623 . . . . 430.34 110.879 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.27 -45.33 92.0 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.078 -0.51 . . . . 667.57 110.785 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.27 -38.45 91.08 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.716 -0.675 . . . . 527.8 110.823 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.02 85.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.887 -0.597 . . . . 169.13 111.528 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.449 ' O ' HG21 ' A' ' 53' ' ' VAL . 88.2 mt -62.24 -38.18 88.25 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.414 -0.357 . . . . 409.47 111.558 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -63.05 -39.01 93.45 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.306 -0.627 . . . . 686.82 109.306 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.401 ' CD2' ' HE3' ' A' ' 118' ' ' MET . 92.2 t80 -62.12 -48.06 81.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.344 -0.844 . . . . 213.85 111.608 178.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 50' ' ' LEU . 17.2 m -68.89 -24.16 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 C-N-CA 121.016 -0.273 . . . . 289.44 111.679 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.88 -41.37 91.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.53 -0.304 . . . . 358.19 110.569 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -62.96 -41.92 99.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.491 -0.322 . . . . 999.99 110.448 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -63.93 -44.03 94.1 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.166 0.507 . . . . 999.99 110.036 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -60.13 -47.47 85.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.226 -0.897 . . . . 212.58 111.113 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.428 ' O ' ' HB2' ' A' ' 62' ' ' TRP . 47.0 ttp -59.33 -45.46 91.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.995 -0.548 . . . . 262.65 111.068 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -64.7 -41.47 95.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.476 -0.329 . . . . 684.75 111.139 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -66.09 -45.5 80.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.22 -0.446 . . . . 450.86 110.787 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -64.38 -42.36 96.19 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.036 -0.529 . . . . 587.54 110.548 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.428 ' HB2' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -60.11 -41.38 92.44 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.607 -0.724 . . . . 785.5 111.827 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.07 91.26 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.378 0.51 . . . . 290.18 112.378 -178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -62.55 -47.84 82.12 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.984 0.421 . . . . 676.15 111.014 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -68.46 -44.35 75.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.916 -0.584 . . . . 824.3 111.188 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.406 ' HB2' ' O ' ' A' ' 62' ' ' TRP . 0.0 OUTLIER -52.18 -39.11 59.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.566 -0.743 . . . . 839.61 112.893 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.39 -41.62 94.19 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.885 0.328 . . . . 667.86 111.885 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -68.09 -40.47 82.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.977 0.418 . . . . 999.99 110.69 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.413 ' O ' HG12 ' A' ' 73' ' ' ILE . 48.7 mm -70.62 -41.25 77.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.709 -0.678 . . . . 648.32 111.293 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -58.94 -40.95 86.2 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.033 -0.53 . . . . 555.82 111.694 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.91 -43.5 98.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.859 0.361 . . . . 912.86 110.541 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -66.58 -44.92 80.92 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.817 -0.629 . . . . 999.99 110.938 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.2 mm -64.38 -45.01 97.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 115.831 -0.622 . . . . 322.08 111.452 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -61.02 -43.79 98.36 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.309 -0.405 . . . . 443.19 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.21 -40.35 97.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.392 -0.367 . . . . 427.97 111.445 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -70.28 -40.54 74.27 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.422 -0.354 . . . . 552.67 111.486 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.63 -8.0 80.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.962 -0.637 . . . . 282.78 112.688 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -74.64 148.82 40.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 999.99 111.588 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.6 p -103.77 106.24 51.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 423.41 110.94 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.441 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 33.0 Cg_exo -60.91 143.88 99.45 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.138 2.559 . . . . 262.13 113.348 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -100.49 -175.78 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 322.52 110.996 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.39 -42.9 89.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-N 116.414 -0.357 . . . . 195.73 110.856 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.53 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -40.43 98.18 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.825 -0.702 . . . . 116.64 112.506 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -64.19 -42.26 96.75 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.851 0.357 . . . . 397.23 110.835 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.441 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 48.2 m-85 -71.16 -35.8 71.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.061 -0.518 . . . . 273.3 111.644 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.53 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -62.43 -35.93 80.8 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.575 0.226 . . . . 391.43 110.779 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -63.56 -45.03 92.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.248 0.547 . . . . 999.99 109.98 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.0 mt -65.82 -40.66 92.03 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.47 -0.786 . . . . 292.18 110.483 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.87 -39.48 98.07 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 115.687 -0.688 . . . . 65.97 112.779 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.7 90.07 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.631 0.253 . . . . 184.99 111.198 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.83 -41.84 97.76 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.27 -0.423 . . . . 381.14 110.421 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.89 -42.26 91.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.744 -0.662 . . . . 354.06 111.171 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.49 -9.16 64.3 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.928 -0.578 . . . . 88.8 113.691 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.31 -30.4 54.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.906 0.384 . . . . 999.99 110.86 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -100.89 120.63 40.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 999.99 110.421 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 80.9 mt -116.48 119.72 62.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.528 -0.306 . . . . 458.46 110.773 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -110.97 24.66 12.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.299 -0.409 . . . . 388.05 111.946 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.7 mmm -61.71 -39.1 90.32 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.602 0.239 . . . . 538.07 111.28 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -39.25 90.13 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.035 0.445 . . . . 282.7 110.798 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -66.05 -35.98 82.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.026 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.465 ' CE2' HD12 ' A' ' 105' ' ' LEU . 87.5 t80 -58.9 -48.95 79.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.329 -0.396 . . . . 504.74 110.514 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -61.01 -47.8 84.74 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.922 -0.581 . . . . 999.99 110.798 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.56 -39.62 91.77 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.8 -0.636 . . . . 558.87 111.776 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.26 98.49 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.551 -0.295 . . . . 412.73 111.393 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.465 HD12 ' CE2' ' A' ' 101' ' ' PHE . 91.0 mt -64.79 -40.81 95.85 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.384 -0.371 . . . . 665.66 110.722 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.43 -43.68 96.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.892 -0.595 . . . . 999.99 111.096 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.85 -40.12 83.31 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.122 -0.49 . . . . 746.24 112.023 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -89.01 -7.24 56.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.587 -0.279 . . . . 999.99 111.287 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 52.9 t30 58.43 32.41 22.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.826 -0.625 . . . . 848.93 111.258 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 22.4 mmt -107.31 98.5 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.063 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.0 mt -94.24 119.67 66.3 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.022 -0.535 . . . . 586.78 110.514 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.36 150.85 65.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.454 2.102 . . . . 310.73 112.163 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -84.8 118.31 24.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.842 0.353 . . . . 866.09 110.56 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.527 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 23.7 m-85 -70.33 107.71 3.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.84 -0.618 . . . . 999.99 111.043 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 89.7 mt -97.72 143.5 26.33 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.605 -0.271 . . . . 579.24 111.264 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 51.5 Cg_exo -58.25 -35.07 99.07 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.071 2.514 . . . . 684.25 112.933 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -63.02 -34.18 77.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.25 -0.432 . . . . 662.15 111.027 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' MET . . . . . 0.401 ' HE3' ' CD2' ' A' ' 52' ' ' PHE . 95.8 mtp -60.17 -40.07 88.64 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.884 0.373 . . . . 999.99 110.129 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.03 -39.9 93.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.755 -0.657 . . . . 675.31 110.183 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.509 ' O ' ' HG3' ' A' ' 124' ' ' MET . 88.5 tt0 -62.92 -41.68 99.55 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.608 -0.723 . . . . 900.95 111.146 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.56 -42.37 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.813 0.34 . . . . 500.83 110.724 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.87 -38.57 82.54 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.08 -0.509 . . . . 834.99 111.129 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -77.71 -9.66 59.11 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.336 0.495 . . . . 999.99 112.336 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.509 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 68.1 mtt -71.54 139.22 49.39 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.653 0.264 . . . . 599.62 111.107 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -52.33 136.13 41.14 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.904 -0.589 . . . . 999.99 111.263 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -54.31 -36.88 88.13 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.039 2.493 . . . . 214.74 113.079 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -25.48 68.07 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.3 -0.409 . . . . 248.66 111.851 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -92.03 -1.77 57.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.455 -0.339 . . . . 360.37 111.383 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 60.1 t -99.94 112.98 64.93 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.669 -0.241 . . . . 334.76 110.745 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.23 152.58 61.73 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.501 2.134 . . . . 351.83 112.347 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 96.7 t -124.38 135.8 62.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 410.42 110.275 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -133.28 134.71 44.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.385 -0.371 . . . . 999.99 110.419 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -84.74 92.46 8.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.981 0.42 . . . . 551.94 110.371 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.282 -0.866 . . . . 965.93 111.345 -179.706 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 120.773 0.32 . . . . 999.99 110.501 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.0 m -114.5 115.54 27.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.899 -0.408 . . . . 999.99 109.899 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.457 ' O ' HD21 ' A' ' 67' ' ' LEU . 37.0 p90 -93.84 -5.12 48.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.461 -0.336 . . . . 999.99 111.836 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -90.84 113.12 25.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 999.99 110.776 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -68.39 -39.77 81.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.107 -0.497 . . . . 999.99 110.607 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.468 ' HB ' ' OD1' ' A' ' 70' ' ' ASN . 73.1 t -124.15 128.51 74.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 521.04 109.852 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -81.36 125.15 79.67 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.597 -0.274 . . . . 999.99 110.826 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.72 151.73 63.81 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.698 2.265 . . . . 546.56 112.788 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -132.76 134.89 45.31 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 999.99 109.722 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 63.81 33.67 12.55 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.582 0.551 . . . . 999.99 111.49 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.26 120.45 7.61 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.257 -0.429 . . . . 999.99 110.953 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -91.48 106.49 18.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.43 -0.35 . . . . 280.85 111.055 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.32 -22.11 66.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.93 -0.577 . . . . 999.99 111.819 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.44 81.43 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.804 0.335 . . . . 200.79 111.488 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -63.4 -37.29 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 518.33 109.98 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.76 -39.37 93.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.745 -0.661 . . . . 524.44 110.419 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.59 -46.92 95.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.812 -0.631 . . . . 407.88 111.285 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.01 99.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.22 -0.445 . . . . 136.03 111.256 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 91.0 mt -67.21 -37.98 84.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.838 -0.619 . . . . 505.3 111.306 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.15 -39.7 83.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.736 -0.665 . . . . 703.51 111.586 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 74.1 t -62.82 -44.26 99.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.606 0.241 . . . . 324.41 110.657 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.82 -40.22 91.63 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.939 0.4 . . . . 685.46 110.744 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.07 -41.98 94.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.748 -0.66 . . . . 238.49 111.317 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.5 mt -60.05 -43.15 92.05 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.49 -0.323 . . . . 509.15 111.193 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -43.98 97.36 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.598 0.237 . . . . 183.06 111.228 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.48 -40.18 96.08 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.068 -0.587 . . . . 63.82 112.495 178.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -72.78 -20.49 61.16 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.384 0.273 . . . . 351.91 111.489 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.37 -36.42 60.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.535 -0.302 . . . . 145.09 110.557 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -60.84 -44.12 97.4 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.329 -0.619 . . . . 999.99 109.329 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.63 -39.07 97.43 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.475 -0.784 . . . . 82.9 112.215 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.529 HD21 ' SD ' ' A' ' 98' ' ' MET . 83.2 mt -62.14 -40.51 96.19 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.458 0.171 . . . . 392.81 111.058 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.4 t -60.96 -43.97 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.191 -0.459 . . . . 455.7 110.702 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.72 -44.6 96.42 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.147 -0.479 . . . . 756.66 111.02 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -68.03 -38.42 82.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.925 0.393 . . . . 999.99 110.179 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.6 mt -62.17 -37.0 83.56 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.929 -0.578 . . . . 373.99 111.611 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -61.87 -37.12 83.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.601 0.238 . . . . 811.35 111.543 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.5 t -87.82 -52.5 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 113.502 0.926 . . . . 461.27 113.502 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -115.36 -5.74 12.32 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.244 0.831 . . . . 575.93 113.244 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.86 93.27 Favored Glycine 0 N--CA 1.46 0.282 0 C-N-CA 121.29 -0.481 . . . . 226.53 113.685 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.8 ptm180 -62.01 -18.66 61.26 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.265 0.468 . . . . 999.99 112.265 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.5 p -106.15 1.07 25.9 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.409 0.522 . . . . 432.8 112.409 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.8 mt -72.27 141.22 48.91 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.0 0.429 . . . . 844.62 111.962 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.0 m -77.78 162.77 26.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.746 -0.661 . . . . 316.62 110.495 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.9 m -60.02 -42.39 94.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.818 0.342 . . . . 291.13 110.96 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.89 -41.96 91.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.125 -0.488 . . . . 467.63 110.799 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.15 -40.91 98.94 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.21 -0.45 . . . . 430.34 111.178 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 64.2 tttm -61.47 -45.7 93.13 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.386 -0.37 . . . . 667.57 110.924 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.03 -38.72 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 527.8 111.019 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.21 -22.94 66.34 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.729 -0.668 . . . . 169.13 112.433 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 47' ' ' LYS . 0.3 OUTLIER -53.85 -36.27 62.4 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.384 0.512 . . . . 409.47 112.384 -179.303 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -62.41 -41.21 98.51 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.796 0.331 . . . . 686.82 110.785 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -70.43 -37.61 74.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 213.85 110.22 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.34 -41.22 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.669 -0.696 . . . . 289.44 111.014 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -59.99 -39.79 86.96 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.778 -0.192 . . . . 358.19 110.943 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -61.62 -46.15 91.04 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.789 0.328 . . . . 999.99 110.235 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -63.28 -41.72 99.03 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.979 -0.555 . . . . 999.99 110.61 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -61.77 -41.52 97.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.568 -0.742 . . . . 212.58 110.036 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 98.2 mtp -64.97 -38.55 91.32 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.961 -0.563 . . . . 262.65 111.364 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.03 -40.9 95.36 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.833 0.679 . . . . 684.75 112.833 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.462 ' HA ' ' SD ' ' A' ' 134' ' ' MET . 75.8 p -68.46 -38.85 81.48 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.694 -0.402 . . . . 450.86 111.371 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.476 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 69.9 m80 -70.7 -40.13 73.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.351 -0.386 . . . . 587.54 111.206 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -63.85 -39.84 95.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 785.5 112.206 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.73 90.65 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.828 0.307 . . . . 290.18 111.828 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -65.04 -46.86 79.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.828 0.347 . . . . 676.15 111.486 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.481 ' O ' HG12 ' A' ' 69' ' ' ILE . 62.7 m-85 -70.54 -40.52 73.35 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.346 -0.388 . . . . 824.3 112.025 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 17.7 tpt -53.76 -50.13 66.71 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.184 0.438 . . . . 839.61 112.184 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 3' ' ' TRP . 94.7 mt -64.95 -39.96 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.957 0.354 . . . . 667.86 111.957 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -61.99 -47.88 82.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 999.99 111.67 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.7 pt -80.11 -24.63 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.43 0.53 . . . . 648.32 112.43 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.468 ' OD1' ' HB ' ' A' ' 6' ' ' VAL . 28.6 t-20 -58.73 -45.52 89.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.613 0.227 . . . . 555.82 111.613 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.23 -41.73 96.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.548 -0.296 . . . . 912.86 111.237 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -70.06 -42.7 72.51 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.135 0.42 . . . . 999.99 112.135 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.83 -46.62 95.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.578 0.228 . . . . 322.08 111.433 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.58 -46.89 86.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.465 -0.334 . . . . 443.19 111.757 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.51 -41.16 96.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.171 0.434 . . . . 427.97 112.171 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.13 -40.6 71.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.875 0.369 . . . . 552.67 111.594 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.1 -8.23 78.93 Favored Glycine 0 CA--C 1.52 0.36 0 C-N-CA 121.042 -0.599 . . . . 282.78 112.287 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.8 mmt-85 -75.22 150.65 38.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.944 0.402 . . . . 999.99 111.546 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 p -107.42 100.98 36.86 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 423.41 110.634 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.508 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 46.0 Cg_exo -59.51 140.98 96.58 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.022 2.481 . . . . 262.13 113.398 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.29 -175.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.766 -0.652 . . . . 322.52 111.115 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.6 t -59.31 -41.6 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 116.375 -0.375 . . . . 195.73 110.909 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.604 ' O ' HG23 ' A' ' 86' ' ' THR . . . -60.38 -40.68 97.88 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.815 -0.707 . . . . 116.64 112.536 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -70.1 -42.29 72.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.018 0.437 . . . . 397.23 110.803 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.508 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 26.5 m-85 -68.0 -34.13 75.94 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.809 -0.632 . . . . 273.3 112.687 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.604 HG23 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -56.03 -32.57 64.13 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.686 0.254 . . . . 391.43 111.686 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -62.48 -45.42 93.11 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.05 0.453 . . . . 999.99 109.982 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.3 mt -66.12 -40.78 90.94 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.695 -0.684 . . . . 292.18 110.559 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.53 -40.64 99.37 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.661 -0.699 . . . . 65.97 112.364 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.91 -40.01 94.0 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.521 0.201 . . . . 184.99 110.836 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -63.44 -40.12 96.31 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.213 -0.449 . . . . 381.14 110.567 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.73 -42.69 96.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.996 -0.547 . . . . 354.06 110.517 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.33 -10.44 66.12 Favored Glycine 0 CA--C 1.522 0.488 0 CA-C-N 115.689 -0.687 . . . . 88.8 113.747 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.512 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.1 mmm180 -79.85 -13.92 59.05 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 117.107 0.454 . . . . 999.99 111.332 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -97.3 114.33 26.08 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.714 -0.476 . . . . 999.99 109.714 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.2 pt -121.8 23.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.325 -0.398 . . . . 458.46 111.817 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -81.64 77.94 8.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 388.05 111.034 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.529 ' SD ' HD21 ' A' ' 31' ' ' LEU . 67.4 mtt -91.75 -2.65 56.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.059 -0.519 . . . . 538.07 110.817 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.31 -37.3 82.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.819 -0.628 . . . . 282.7 110.898 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -58.64 -44.94 90.23 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.472 -0.785 . . . . 999.99 111.205 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.445 ' CE2' HD13 ' A' ' 105' ' ' LEU . 90.5 t80 -56.67 -48.3 77.91 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.443 -0.344 . . . . 504.74 111.285 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -65.0 -39.84 94.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 999.99 111.051 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.34 -41.8 98.9 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.064 -0.516 . . . . 558.87 110.69 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.82 92.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.929 -0.578 . . . . 412.73 111.466 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.445 HD13 ' CE2' ' A' ' 101' ' ' PHE . 88.3 mt -63.0 -42.07 99.75 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.43 -0.35 . . . . 665.66 110.862 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -63.72 -39.52 94.51 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 116.339 -0.392 . . . . 999.99 110.953 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.84 -39.8 82.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.063 -0.517 . . . . 746.24 111.545 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -84.56 -11.91 55.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.344 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.9 t30 54.38 42.96 31.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.953 -0.567 . . . . 848.93 111.524 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 63.3 tpp -127.87 118.64 24.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 999.99 111.107 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.0 mt -94.82 119.04 66.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 586.78 110.085 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.27 140.48 37.22 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.243 1.962 . . . . 310.73 112.83 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -85.88 150.39 24.56 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.063 -0.517 . . . . 866.09 110.846 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -67.61 125.27 25.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.784 0.326 . . . . 999.99 110.483 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.8 mt -98.96 145.61 30.26 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 579.24 111.336 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.86 -24.43 53.84 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.637 2.225 . . . . 684.25 111.97 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.85 -34.92 78.35 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.502 -0.772 . . . . 662.15 110.915 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.9 mtt -59.95 -39.5 85.78 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.091 -0.504 . . . . 999.99 110.483 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -61.44 -41.59 97.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.104 -0.498 . . . . 675.31 110.674 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -64.78 -42.18 95.28 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.074 -0.512 . . . . 900.95 110.828 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.8 mm -62.02 -46.65 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.088 -0.505 . . . . 500.83 111.07 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.5 -41.93 96.13 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.138 -0.483 . . . . 834.99 112.189 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -65.1 -35.81 82.31 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.448 0.536 . . . . 999.99 112.448 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.4 mtm -90.73 134.5 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.036 0.384 . . . . 599.62 112.036 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -53.09 146.13 21.41 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.755 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.24 -37.54 88.11 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.028 2.485 . . . . 214.74 112.949 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.77 -19.76 61.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.289 -0.414 . . . . 248.66 112.072 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -91.59 -21.67 20.71 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.185 0.439 . . . . 360.37 112.185 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.4 m -90.65 146.71 34.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.848 0.356 . . . . 334.76 111.306 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.53 156.73 53.75 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.702 2.268 . . . . 351.83 112.952 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.8 t -115.87 137.08 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.34 -0.615 . . . . 410.42 109.34 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -144.59 140.88 29.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.603 -0.271 . . . . 999.99 110.573 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -82.83 175.59 9.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.085 -0.507 . . . . 551.94 110.302 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.462 ' SD ' ' HA ' ' A' ' 60' ' ' THR . 27.9 ptm . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.3 -0.857 . . . . 965.93 110.961 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 111.831 0.308 . . . . 999.99 111.831 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.483 ' C ' ' H ' ' A' ' 4' ' ' HIS . 80.0 p -111.63 -13.34 13.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.651 0.262 . . . . 999.99 110.511 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.7 m0 68.54 -17.14 0.19 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.926 0.89 . . . . 999.99 112.658 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.483 ' H ' ' C ' ' A' ' 2' ' ' SER . 96.7 m-70 59.02 25.86 14.38 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.309 0.643 . . . . 999.99 112.138 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -145.65 -97.56 0.1 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.016 0.436 . . . . 999.99 110.885 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 71.3 t -119.68 125.36 74.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.007 -0.542 . . . . 521.04 110.354 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -82.46 147.44 56.25 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.477 -0.329 . . . . 999.99 110.901 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.71 152.41 47.66 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.73 2.287 . . . . 546.56 112.861 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -88.95 61.27 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.458 -0.337 . . . . 999.99 111.457 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 54.94 47.74 21.52 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.783 -0.644 . . . . 999.99 112.237 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.8 mt -56.68 142.27 40.68 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.322 -0.399 . . . . 999.99 111.064 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.37 114.06 19.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 280.85 111.102 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -64.12 -24.11 67.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.81 -0.632 . . . . 999.99 111.999 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.91 -39.16 84.48 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.885 0.374 . . . . 200.79 111.182 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -65.35 -34.88 79.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 518.33 109.965 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -64.15 -40.12 95.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.567 -0.742 . . . . 524.44 110.1 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.06 -46.87 95.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.774 -0.648 . . . . 407.88 111.186 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.04 -41.6 98.29 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.0 -0.546 . . . . 136.03 111.059 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -67.98 -41.03 82.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 505.3 111.428 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.98 -40.48 84.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.95 -0.568 . . . . 703.51 111.78 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.21 -43.78 98.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.726 0.298 . . . . 324.41 110.535 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.66 -39.12 91.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.393 . . . . 685.46 110.947 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.509 HG22 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -62.48 -42.37 95.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.153 -0.476 . . . . 238.49 110.603 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 91.9 mt -60.06 -41.14 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.693 -0.685 . . . . 509.15 111.642 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.51 -43.29 93.43 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.724 0.268 . . . . 183.06 111.724 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.44 -41.82 97.85 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.684 -0.77 . . . . 63.82 112.515 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -74.26 -18.29 60.75 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.963 0.357 . . . . 351.91 111.963 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -75.79 -31.49 59.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.401 -0.363 . . . . 145.09 110.908 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 32' ' ' VAL . 26.8 mmm180 -62.8 -39.71 95.08 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.366 -0.605 . . . . 999.99 109.366 178.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.65 -35.78 91.69 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.376 -0.829 . . . . 82.9 112.409 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 77.0 mt -61.88 -42.77 99.46 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.078 0.399 . . . . 392.81 112.078 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 29' ' ' ARG . 33.5 m -74.23 -32.2 31.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 C-N-CA 120.651 -0.42 . . . . 455.7 111.298 -179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.09 -40.64 94.88 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.919 0.39 . . . . 756.66 110.576 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 59.0 t90 -66.44 -39.5 88.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.031 -0.532 . . . . 999.99 109.582 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.13 -37.04 83.65 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.561 -0.745 . . . . 373.99 111.071 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.18 -36.66 84.36 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.644 0.259 . . . . 811.35 111.464 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.04 -51.62 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 113.599 0.963 . . . . 461.27 113.599 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -108.55 -4.67 17.01 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.274 0.842 . . . . 575.93 113.274 -177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.28 -12.23 72.28 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.125 -0.559 . . . . 226.53 113.95 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -61.18 -40.22 93.09 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.818 0.309 . . . . 999.99 111.339 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.8 p -112.36 8.7 19.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.517 -0.31 . . . . 432.8 111.796 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.0 tp -71.46 131.69 43.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.373 -0.376 . . . . 844.62 111.32 -179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.0 t -70.54 152.34 44.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.136 -0.483 . . . . 316.62 110.732 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.7 m -59.88 -41.48 91.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.184 -0.462 . . . . 291.13 111.367 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 2.1 t -68.76 -37.35 77.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.885 0.374 . . . . 467.63 110.464 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.413 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 97.5 mt-30 -64.13 -38.28 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.973 -0.558 . . . . 430.34 111.073 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.04 -45.11 93.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 667.57 110.682 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -63.47 -40.4 97.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.003 0.43 . . . . 527.8 110.408 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.411 ' O ' HG22 ' A' ' 53' ' ' VAL . . . -62.17 -39.07 91.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.705 -0.68 . . . . 169.13 111.338 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.95 -44.13 94.58 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.932 -0.576 . . . . 409.47 111.78 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -62.21 -40.25 95.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 686.82 110.288 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -62.72 -44.78 95.35 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.129 -0.487 . . . . 213.85 110.012 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 49' ' ' ALA . 56.7 t -60.36 -40.43 83.96 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 CA-C-N 115.903 -0.589 . . . . 289.44 110.097 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.93 -45.34 90.63 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.387 -0.37 . . . . 358.19 110.714 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -64.27 -42.46 96.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.762 0.315 . . . . 999.99 110.859 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -63.85 -44.71 92.35 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.234 0.54 . . . . 999.99 110.099 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -60.71 -46.95 88.43 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.249 -0.887 . . . . 212.58 110.936 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.509 ' SD ' HG22 ' A' ' 23' ' ' ILE . 5.9 ttp -59.45 -44.59 92.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.181 -0.463 . . . . 262.65 110.955 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -64.33 -42.23 96.39 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.882 0.372 . . . . 684.75 110.731 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.1 m -64.72 -44.89 88.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.886 -0.597 . . . . 450.86 110.772 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -63.96 -44.92 91.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.783 -0.644 . . . . 587.54 110.268 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -62.06 -45.1 95.05 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.65 -0.704 . . . . 785.5 111.713 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.45 79.66 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.396 0.517 . . . . 290.18 112.396 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -61.07 -48.54 81.27 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.643 0.259 . . . . 676.15 110.85 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -71.63 -39.02 70.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.413 . . . . 824.3 111.612 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 28.1 ttt -52.16 -46.27 65.41 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.551 0.575 . . . . 839.61 112.551 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.66 -42.14 96.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.713 -0.221 . . . . 667.86 111.331 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -68.67 -40.14 80.28 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.977 0.418 . . . . 999.99 110.492 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.3 -44.13 98.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 115.6 -0.727 . . . . 648.32 110.496 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.85 -41.49 91.56 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.06 -0.518 . . . . 555.82 111.2 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.99 -42.33 99.02 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.53 -0.305 . . . . 912.86 110.682 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.9 -41.59 91.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.148 -0.478 . . . . 999.99 110.808 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -62.67 -46.23 96.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.911 -0.586 . . . . 322.08 110.663 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -61.59 -45.09 95.6 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.99 -0.55 . . . . 443.19 111.508 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.23 -41.01 99.05 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.47 -0.332 . . . . 427.97 111.764 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.94 -41.01 71.69 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.027 0.442 . . . . 552.67 111.345 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.33 -11.1 70.81 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.875 -0.602 . . . . 282.78 112.504 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.6 mpt_? -75.64 145.7 40.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.782 0.325 . . . . 999.99 111.432 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.424 ' O ' HG21 ' A' ' 79' ' ' THR . 7.0 t -91.6 116.53 66.63 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 121.009 0.433 . . . . 423.41 110.567 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.66 145.12 40.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.617 2.212 . . . . 262.13 113.304 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 m -102.07 178.47 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 322.52 110.849 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.0 t -60.83 -42.53 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.241 -0.436 . . . . 195.73 110.517 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.28 -39.58 96.24 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 121.107 -0.568 . . . . 116.64 112.777 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.91 -40.58 95.95 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.023 0.439 . . . . 397.23 110.259 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -67.44 -39.08 85.4 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.617 -0.719 . . . . 273.3 111.763 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.6 p -65.81 -34.81 79.03 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 111.9 0.333 . . . . 391.43 111.9 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -64.79 -41.54 95.76 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.005 0.431 . . . . 999.99 110.172 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -69.88 -40.5 75.65 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.698 -0.683 . . . . 292.18 110.623 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.8 -39.86 98.51 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.599 -0.728 . . . . 65.97 113.004 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.21 96.28 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.662 0.267 . . . . 184.99 111.135 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.67 -40.82 97.8 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.262 -0.426 . . . . 381.14 110.674 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.45 -42.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.811 -0.631 . . . . 354.06 110.865 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.95 -16.85 62.4 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.933 -0.576 . . . . 88.8 113.542 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -79.85 -13.82 59.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.864 0.332 . . . . 999.99 111.227 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -108.22 114.71 28.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 999.99 110.584 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.6 mt -125.52 118.59 52.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 458.46 110.471 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -106.02 19.27 20.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.544 -0.298 . . . . 388.05 111.789 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.0 mtp -62.29 -38.3 88.83 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.04 0.385 . . . . 538.07 112.04 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.1 -39.59 90.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.096 0.474 . . . . 282.7 110.551 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.75 -24.48 59.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.666 -0.697 . . . . 999.99 111.269 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -58.16 -48.71 79.45 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.14 -0.482 . . . . 504.74 110.995 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.09 -39.46 94.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.393 -0.367 . . . . 999.99 111.005 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.92 -44.9 95.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.195 -0.457 . . . . 558.87 110.903 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.76 -41.23 99.13 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.104 -0.498 . . . . 412.73 111.319 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.99 -45.12 86.92 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.159 -0.473 . . . . 665.66 111.258 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -64.61 -39.82 94.41 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.482 -0.326 . . . . 999.99 111.269 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.06 -43.89 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.162 -0.472 . . . . 746.24 111.99 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -91.38 -3.76 56.4 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.412 -0.358 . . . . 999.99 111.317 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.4 t30 57.53 37.44 27.66 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.235 0.614 . . . . 848.93 111.139 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 38.6 mmt -105.8 83.57 1.94 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.982 -0.554 . . . . 999.99 110.675 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.417 HD12 HG21 ' A' ' 111' ' ' ILE . 50.6 mm -94.51 116.67 66.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.458 -0.337 . . . . 586.78 110.789 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.37 157.68 45.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.728 2.285 . . . . 310.73 112.651 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -80.12 126.27 30.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.464 -0.335 . . . . 866.09 110.348 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.413 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 16.1 m-85 -70.03 90.96 0.66 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 999.99 111.33 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.7 145.31 29.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.485 -0.325 . . . . 579.24 110.477 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -79.51 45.3 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.493 2.129 . . . . 684.25 113.009 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -70.58 -29.22 65.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 662.15 110.393 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' MET . . . . . 0.491 ' O ' HG23 ' A' ' 121' ' ' ILE . 60.1 ttp -58.7 -43.31 90.02 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.608 -0.724 . . . . 999.99 111.113 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -61.11 -41.44 96.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.536 -0.302 . . . . 675.31 110.621 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.96 -41.22 82.78 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.011 -0.541 . . . . 900.95 111.911 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.491 HG23 ' O ' ' A' ' 118' ' ' MET . 7.7 tp -73.52 -28.32 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 111.707 0.262 . . . . 500.83 111.707 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -70.21 -17.43 63.14 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.614 -0.266 . . . . 834.99 111.698 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -65.04 -33.13 75.3 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.467 -0.333 . . . . 999.99 111.614 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.4 mtm -95.47 134.63 38.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.643 -0.253 . . . . 599.62 111.174 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.495 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.0 mtt-85 -52.53 139.34 39.0 Favored Pre-proline 0 N--CA 1.465 0.281 0 CA-C-N 116.203 -0.453 . . . . 999.99 110.851 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -60.22 -26.09 81.71 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.869 2.379 . . . . 214.74 113.274 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.71 -36.8 81.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 248.66 111.647 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -92.19 -1.2 57.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.389 -0.368 . . . . 360.37 111.961 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.5 t -87.15 120.5 71.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.684 0.278 . . . . 334.76 110.711 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.83 158.4 55.65 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.512 2.142 . . . . 351.83 112.311 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 88.0 t -106.0 137.59 35.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.207 -0.452 . . . . 410.42 110.109 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -78.93 116.56 19.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.023 0.44 . . . . 999.99 110.951 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -84.18 153.28 23.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.83 -0.623 . . . . 551.94 110.623 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.154 -0.927 . . . . 965.93 110.908 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.698 0.285 . . . . 999.99 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 m -101.39 3.0 40.08 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.015 0.376 . . . . 999.99 112.015 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER 59.24 61.13 2.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.398 0.436 . . . . 999.99 111.726 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -82.22 -1.02 47.86 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.203 -0.453 . . . . 999.99 111.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -81.53 -160.86 0.37 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.257 -0.429 . . . . 999.99 110.922 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.3 m -99.98 142.31 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.02 0.438 . . . . 521.04 111.116 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.87 150.67 66.1 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.482 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HA ' ' OD2' ' A' ' 74' ' ' ASP . 50.5 Cg_endo -68.38 138.2 41.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.268 1.979 . . . . 546.56 112.687 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -102.59 -9.3 20.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.009 -0.542 . . . . 999.99 110.639 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -107.22 9.14 30.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 999.99 111.104 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -57.13 125.92 24.87 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.987 -0.551 . . . . 999.99 111.104 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -108.53 113.94 27.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.507 -0.315 . . . . 280.85 110.38 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 58.3 mtmt -62.48 -39.18 92.64 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.101 -0.5 . . . . 999.99 111.782 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.509 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -59.76 -39.72 85.8 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.936 0.398 . . . . 200.79 111.54 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -71.34 -29.31 64.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.24 -0.437 . . . . 518.33 110.72 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.409 ' OE1' ' HA ' ' A' ' 13' ' ' LYS . 54.3 mt-10 -64.62 -40.72 95.99 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.899 -0.592 . . . . 524.44 112.115 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 14' ' ' ALA . 27.8 m -68.7 -35.21 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 120.457 -0.497 . . . . 407.88 111.715 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.83 -41.55 95.98 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.002 0.43 . . . . 136.03 110.003 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 85' ' ' TYR . 58.1 tp -68.82 -40.42 79.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.691 -0.686 . . . . 505.3 111.132 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -60.23 -38.01 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.04 -0.527 . . . . 703.51 111.881 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.435 ' O ' HG23 ' A' ' 24' ' ' ILE . 69.0 t -63.04 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.622 0.249 . . . . 324.41 110.944 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.29 -41.52 89.68 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.644 0.259 . . . . 685.46 111.261 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.6 mt -70.09 -44.13 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.177 -0.465 . . . . 238.49 111.789 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.435 HG23 ' O ' ' A' ' 21' ' ' VAL . 6.3 tp -63.42 -33.9 64.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 CA-C-N 116.289 -0.414 . . . . 509.15 111.85 -178.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.57 -45.98 91.81 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.016 0.376 . . . . 183.06 112.016 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.28 -44.83 84.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.572 -0.823 . . . . 63.82 113.147 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -72.65 -18.66 61.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.194 0.442 . . . . 351.91 112.194 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.435 ' O ' HG21 ' A' ' 32' ' ' VAL . 34.2 t70 -74.8 -39.48 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.1 -0.24 . . . . 145.09 111.561 -178.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -63.84 -41.34 97.84 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.616 -0.434 . . . . 999.99 110.174 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -41.02 99.84 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.831 -0.622 . . . . 82.9 112.078 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.7 tp -63.53 -44.42 94.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.682 0.277 . . . . 392.81 110.367 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 28' ' ' ASP . 64.5 t -61.61 -44.6 98.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-N 116.11 -0.496 . . . . 455.7 110.813 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -62.24 -40.29 95.65 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.51 -0.314 . . . . 756.66 110.977 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 52.1 t90 -65.33 -42.01 93.38 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.398 -0.593 . . . . 999.99 109.398 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.431 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 86.6 mt -62.69 -35.49 79.88 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.271 -0.877 . . . . 373.99 111.296 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.94 -36.08 80.34 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.754 0.279 . . . . 811.35 111.754 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -86.31 -51.03 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 113.684 0.994 . . . . 461.27 113.684 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.613 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.2 m-70 -101.18 0.97 38.57 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 575.93 113.132 -177.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -60.88 -36.48 92.11 Favored Glycine 0 N--CA 1.461 0.327 0 N-CA-C 114.095 0.398 . . . . 226.53 114.095 -179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -58.94 -39.42 81.57 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.818 0.303 . . . . 999.99 111.818 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -89.76 -10.19 46.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.861 0.689 . . . . 432.8 112.861 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 88.1 mt -73.0 138.38 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.89 0.376 . . . . 844.62 111.79 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.6 p -78.16 169.11 18.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 316.62 110.011 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.98 -42.27 98.05 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.751 0.31 . . . . 291.13 110.972 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 75.1 t -66.69 -43.26 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 116.232 -0.44 . . . . 467.63 111.145 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -63.19 -40.29 97.07 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.104 0.409 . . . . 430.34 112.104 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -61.09 -46.15 91.8 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.68 0.276 . . . . 667.57 111.061 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -70.67 -37.66 73.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.352 -0.385 . . . . 527.8 111.101 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.9 -36.77 80.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 169.13 111.888 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.55 -37.08 80.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.056 0.391 . . . . 409.47 112.056 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -61.56 -38.96 89.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.62 -0.511 . . . . 686.82 109.62 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -66.99 -39.32 87.13 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.742 -0.663 . . . . 213.85 109.481 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.543 HG12 ' CE2' ' A' ' 101' ' ' PHE . 53.6 t -61.16 -39.6 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.544 -0.753 . . . . 289.44 111.062 179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -58.31 -42.33 86.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.436 -0.347 . . . . 358.19 110.731 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.4 ' NH2' HG22 ' A' ' 121' ' ' ILE . 94.9 mtm-85 -66.35 -39.35 89.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.152 -0.219 . . . . 999.99 110.46 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -63.51 -38.67 92.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.227 0.537 . . . . 999.99 109.751 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.72 -46.4 89.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.06 -0.973 . . . . 212.58 109.555 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 87.1 mtp -61.49 -42.99 99.63 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.768 -0.651 . . . . 262.65 110.865 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -62.72 -40.01 95.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.663 -0.699 . . . . 684.75 112.301 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -61.22 -49.32 77.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.734 0.302 . . . . 450.86 111.619 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -72.66 -39.31 67.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 587.54 111.92 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -64.58 -43.87 92.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 785.5 112.265 -178.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.64 -39.8 81.56 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.869 0.692 . . . . 290.18 112.869 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -60.8 -47.58 85.67 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.738 -0.21 . . . . 676.15 111.546 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -71.28 -42.44 68.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.703 0.287 . . . . 824.3 111.77 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 96.9 mmm -56.39 -41.82 76.91 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 113.494 0.924 . . . . 839.61 113.494 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.2 tp -58.99 -46.62 87.69 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.189 0.44 . . . . 667.86 112.189 -177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -65.63 -42.45 91.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.863 0.363 . . . . 999.99 111.267 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.2 mm -72.0 -43.77 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 116.016 -0.538 . . . . 648.32 112.098 -179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.35 -38.77 88.18 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.942 0.349 . . . . 555.82 111.942 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -59.96 -45.94 91.01 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.697 -0.483 . . . . 912.86 109.697 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.89 -40.97 92.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.894 -0.594 . . . . 999.99 110.972 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 92.5 mt -62.26 -48.09 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.34 -0.391 . . . . 322.08 111.2 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 8' ' ' PRO . 95.5 m-20 -63.39 -42.63 98.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 443.19 111.712 -179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.06 89.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 427.97 112.016 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -40.15 61.56 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.851 0.357 . . . . 552.67 111.55 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.28 -9.95 73.94 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.152 -0.547 . . . . 282.78 112.827 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -75.31 133.94 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.381 -0.229 . . . . 999.99 110.381 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.8 p -73.93 139.38 76.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.785 -0.189 . . . . 423.41 111.12 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.58 145.05 32.7 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.505 2.136 . . . . 262.13 113.203 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.7 m -102.68 170.23 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.936 -0.575 . . . . 322.52 110.854 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.92 -40.08 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.758 0.313 . . . . 195.73 110.461 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.1 -38.86 93.64 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.071 -0.513 . . . . 116.64 112.444 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -61.66 -42.71 99.28 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.96 -0.385 . . . . 397.23 109.96 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' O ' HD12 ' A' ' 19' ' ' LEU . 56.9 m-85 -66.3 -40.45 89.99 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.755 -0.657 . . . . 273.3 111.27 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.7 p -66.12 -32.98 74.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.595 0.22 . . . . 391.43 111.595 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -61.73 -46.07 91.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.405 -0.591 . . . . 999.99 109.405 178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.75 -40.74 88.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.465 -0.789 . . . . 292.18 110.347 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.61 -39.57 98.05 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.439 -0.8 . . . . 65.97 113.685 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -60.54 -40.48 91.7 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.695 0.283 . . . . 184.99 110.988 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.61 -40.5 95.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.981 -0.554 . . . . 381.14 110.241 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.73 -43.43 96.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.56 -0.746 . . . . 354.06 111.146 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.24 -13.92 63.18 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-N 115.824 -0.625 . . . . 88.8 114.001 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -79.38 -15.66 57.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.305 0.552 . . . . 999.99 111.479 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -108.66 111.81 23.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 999.99 110.93 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 77.4 mt -124.47 120.35 58.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.809 -0.441 . . . . 458.46 109.809 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -152.6 55.21 0.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 388.05 111.2 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.4 mmm -64.48 -38.83 92.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.009 -0.542 . . . . 538.07 111.704 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.38 89.37 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 282.7 111.675 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -60.02 -47.52 85.51 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.918 -0.583 . . . . 999.99 111.637 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.543 ' CE2' HG12 ' A' ' 53' ' ' VAL . 49.8 t80 -57.75 -45.73 85.49 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.122 0.264 . . . . 504.74 111.062 -179.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.56 -48.13 82.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.569 0.223 . . . . 999.99 110.546 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.94 -41.69 99.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.417 -0.356 . . . . 558.87 110.98 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.48 94.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.101 -0.5 . . . . 412.73 111.055 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.461 HD12 ' O ' ' A' ' 110' ' ' MET . 59.6 tp -61.07 -43.79 98.35 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.652 -0.703 . . . . 665.66 110.587 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -62.96 -39.84 95.87 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.189 -0.46 . . . . 999.99 110.557 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.38 -40.36 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.741 -0.663 . . . . 746.24 111.503 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -82.74 -11.52 58.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.324 -0.398 . . . . 999.99 111.507 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.9 t30 54.89 44.91 27.59 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.527 0.517 . . . . 848.93 111.576 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' MET . . . . . 0.461 ' O ' HD12 ' A' ' 105' ' ' LEU . 66.9 mtt -115.39 83.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 999.99 110.878 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.417 HD12 HG23 ' A' ' 111' ' ' ILE . 49.8 mm -93.42 116.81 67.02 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.657 0.265 . . . . 586.78 110.642 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.54 150.31 45.56 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.718 2.279 . . . . 310.73 112.754 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -84.25 142.18 30.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 866.09 110.225 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -68.13 113.77 6.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 999.99 110.653 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -99.31 148.63 34.92 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.099 -0.5 . . . . 579.24 111.364 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.93 -19.2 58.33 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.841 2.361 . . . . 684.25 111.873 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -61.53 -35.88 78.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.743 . . . . 662.15 110.855 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 17.8 tpt -58.41 -42.23 86.72 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.081 -0.508 . . . . 999.99 110.574 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.17 -40.4 93.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.16 -0.473 . . . . 675.31 110.429 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -63.66 -42.31 98.1 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.115 -0.493 . . . . 900.95 111.031 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.4 HG22 ' NH2' ' A' ' 55' ' ' ARG . 32.0 mm -61.67 -45.14 99.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 116.433 -0.349 . . . . 500.83 110.807 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.968 -0.56 . . . . 834.99 111.524 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -67.6 -33.66 75.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.293 0.479 . . . . 999.99 112.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -80.3 137.36 36.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 599.62 112.034 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.473 ' O ' HG22 ' A' ' 129' ' ' VAL . 96.2 mtt-85 -53.5 144.04 34.28 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.413 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.46 -33.77 68.89 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.116 2.544 . . . . 214.74 112.86 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.457 ' HA ' ' CG1' ' A' ' 17' ' ' VAL . . . -60.75 -35.94 77.66 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.066 -0.515 . . . . 248.66 111.809 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -91.27 0.97 57.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.41 -0.359 . . . . 360.37 111.944 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 125' ' ' ARG . 57.5 t -96.0 111.15 55.25 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.779 0.323 . . . . 334.76 110.811 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -77.04 163.05 31.29 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.782 2.321 . . . . 351.83 112.969 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.4 m -120.9 153.92 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.053 -0.521 . . . . 410.42 109.857 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -116.75 124.06 48.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.041 0.448 . . . . 999.99 111.352 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -83.2 148.95 27.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 551.94 109.825 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.032 -0.985 . . . . 965.93 110.945 -179.503 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 120.51 0.195 . . . . 999.99 110.496 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -152.08 146.77 25.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.596 -0.274 . . . . 999.99 110.466 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 54.0 m0 -110.27 130.78 55.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.93 -0.396 . . . . 999.99 109.93 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.1 m170 -111.46 17.71 19.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.552 -0.295 . . . . 999.99 111.583 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -107.27 -99.46 0.36 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.687 0.28 . . . . 999.99 110.949 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.4 t -119.34 122.13 68.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.22 -0.289 . . . . 521.04 110.22 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -90.72 121.94 67.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.494 -0.321 . . . . 999.99 110.982 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -59.91 146.86 94.79 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.7 2.267 . . . . 546.56 112.06 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -61.64 -40.29 94.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.331 -0.395 . . . . 999.99 111.777 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -148.81 90.2 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.179 -0.208 . . . . 999.99 111.084 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 56.9 tp -58.98 122.91 14.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.276 -0.42 . . . . 999.99 110.381 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -101.43 102.65 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.921 0.391 . . . . 280.85 110.61 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -65.06 -38.51 91.04 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.799 -0.637 . . . . 999.99 112.052 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.71 84.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.043 0.386 . . . . 200.79 112.043 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.018 -0.364 . . . . 518.33 110.018 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -63.89 -40.58 96.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.875 -0.602 . . . . 524.44 110.456 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -62.18 -47.32 93.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.963 -0.562 . . . . 407.88 111.19 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.94 98.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 136.03 111.453 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' O ' HG13 ' A' ' 23' ' ' ILE . 85.3 mt -69.06 -39.01 79.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.273 0.471 . . . . 505.3 112.273 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -57.56 -42.85 83.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.861 1.06 . . . . 703.51 113.861 -177.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.29 -37.23 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.211 -0.595 . . . . 324.41 111.232 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -70.89 -39.89 72.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 685.46 110.718 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.646 HG23 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -63.58 -43.64 98.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.672 -0.694 . . . . 238.49 111.177 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -59.64 -42.83 89.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.008 -0.542 . . . . 509.15 111.409 -178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.51 96.7 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.042 -0.263 . . . . 183.06 111.385 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.26 -42.87 93.92 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 120.898 -0.668 . . . . 63.82 112.938 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -73.37 -20.15 60.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.959 0.355 . . . . 351.91 111.959 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -77.17 -33.89 56.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.662 -0.245 . . . . 145.09 110.732 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -61.55 -42.71 99.23 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 109.807 -0.442 . . . . 999.99 109.807 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.19 -38.67 82.82 Favored Glycine 0 CA--C 1.519 0.293 0 CA-C-N 115.846 -0.615 . . . . 82.9 112.141 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.9 tp -62.87 -44.64 95.58 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.238 0.458 . . . . 392.81 112.238 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.62 -31.79 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 120.799 -0.36 . . . . 455.7 111.588 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -40.79 97.31 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.918 0.39 . . . . 756.66 109.964 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -64.03 -43.85 94.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.599 -0.728 . . . . 999.99 109.904 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.76 -37.58 84.81 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.176 -0.92 . . . . 373.99 111.575 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -68.31 -20.28 64.74 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.983 0.364 . . . . 811.35 111.983 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.1 t -84.09 -41.45 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.914 0.388 . . . . 461.27 111.136 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -103.92 19.08 20.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.884 0.373 . . . . 575.93 110.895 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.51 -35.88 82.13 Favored Glycine 0 N--CA 1.459 0.228 0 CA-C-N 115.529 -0.76 . . . . 226.53 114.122 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -59.74 -39.59 85.25 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.936 0.346 . . . . 999.99 111.936 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.2 p -110.24 12.22 23.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.66 0.615 . . . . 432.8 112.66 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.35 123.69 22.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 844.62 111.663 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HB2' ' HB2' ' A' ' 46' ' ' GLN . 70.7 m -78.67 154.66 29.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.092 -0.504 . . . . 316.62 110.491 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -61.1 -46.45 90.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.862 0.319 . . . . 291.13 111.862 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.5 t -73.01 -30.23 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 121.114 0.483 . . . . 467.63 110.452 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 43' ' ' SER . 64.6 tt0 -60.62 -38.98 86.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.462 -0.79 . . . . 430.34 111.27 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -59.29 -46.32 88.87 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 110.342 -0.244 . . . . 667.57 110.342 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.43 -39.4 92.06 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.987 0.422 . . . . 527.8 110.595 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.4 87.82 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.741 -0.663 . . . . 169.13 111.818 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.42 HD21 ' O ' ' A' ' 46' ' ' GLN . 1.8 mm? -57.42 -37.01 72.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.269 -0.423 . . . . 409.47 111.975 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -63.75 -40.75 97.46 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.736 0.303 . . . . 686.82 110.217 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.96 -43.55 92.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.968 -0.56 . . . . 213.85 109.94 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 68.6 t -61.19 -41.03 87.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.487 -0.779 . . . . 289.44 110.077 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -59.7 -42.72 93.64 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.91 -0.586 . . . . 358.19 110.272 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.71 -41.61 98.06 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.702 -0.227 . . . . 999.99 110.91 179.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -62.13 -45.54 93.02 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.024 0.44 . . . . 999.99 110.064 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -60.4 -45.92 91.83 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.602 -0.726 . . . . 212.58 110.156 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.646 ' SD ' HG23 ' A' ' 23' ' ' ILE . 30.3 ttp -58.81 -42.92 90.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.304 -0.862 . . . . 262.65 110.821 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.33 -42.35 98.97 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.276 -0.42 . . . . 684.75 111.832 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.3 p -71.55 -39.09 70.89 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 111.69 0.255 . . . . 450.86 111.69 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -64.25 -45.83 86.42 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.139 0.495 . . . . 587.54 110.406 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.463 ' CZ2' HD13 ' A' ' 23' ' ' ILE . 13.3 m95 -65.78 -39.65 91.2 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.691 -0.686 . . . . 785.5 112.538 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -43.19 89.64 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.084 0.402 . . . . 290.18 112.084 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.03 -47.41 83.18 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.858 0.361 . . . . 676.15 111.108 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -68.38 -44.34 75.38 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.053 -0.521 . . . . 824.3 111.326 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.2 ttp -53.56 -46.03 70.09 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.752 -0.658 . . . . 839.61 112.195 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.9 mt -61.54 -39.88 92.65 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.716 0.265 . . . . 667.86 111.716 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -62.07 -47.79 83.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.448 -0.342 . . . . 999.99 111.656 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 pt -80.42 -28.09 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.671 0.619 . . . . 648.32 112.671 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -61.45 -40.2 93.65 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.526 0.203 . . . . 555.82 111.433 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.76 -42.18 98.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.488 -0.324 . . . . 912.86 110.592 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -67.96 -42.14 81.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 999.99 111.044 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.86 -46.91 92.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.291 -0.413 . . . . 322.08 111.063 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -63.37 -43.86 96.45 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.211 -0.449 . . . . 443.19 111.471 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.98 95.93 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.214 -0.448 . . . . 427.97 111.823 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.35 -40.68 67.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.473 -0.33 . . . . 552.67 111.173 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -8.17 79.55 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.89 -0.672 . . . . 282.78 112.706 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.0 mtp180 -74.23 142.83 45.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.787 0.327 . . . . 999.99 110.864 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.2 p -103.21 113.07 66.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.487 -0.324 . . . . 423.41 111.146 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.61 151.64 58.62 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.596 2.197 . . . . 262.13 112.829 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -100.68 178.52 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.938 -0.574 . . . . 322.52 111.512 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.5 t -59.71 -43.41 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.868 -0.606 . . . . 195.73 110.937 -179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.27 -40.84 97.93 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.789 -0.72 . . . . 116.64 112.463 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.001 0.429 . . . . 397.23 110.154 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -64.75 -39.08 93.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.618 -0.719 . . . . 273.3 112.044 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.9 p -65.87 -33.13 75.12 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.829 0.307 . . . . 391.43 111.829 -179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -61.94 -47.09 86.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.089 0.471 . . . . 999.99 109.969 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 10.9 mp -70.12 -40.25 74.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.728 -0.669 . . . . 292.18 110.575 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.68 -39.75 97.84 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.74 -0.664 . . . . 65.97 112.81 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.14 93.13 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.738 0.304 . . . . 184.99 110.887 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.23 -40.84 94.59 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.129 -0.487 . . . . 381.14 110.173 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.96 -43.11 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.818 . . . . 354.06 111.183 179.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.59 -24.88 66.57 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 116.156 -0.475 . . . . 88.8 113.578 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -81.18 -12.67 59.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 0.329 . . . . 999.99 111.804 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.4 mmt180 -108.38 112.43 24.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.97 0.414 . . . . 999.99 111.366 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 pt -134.32 153.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 458.46 110.623 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -152.93 43.23 0.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.048 0.452 . . . . 388.05 110.664 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.7 mtp -65.23 -36.55 84.51 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.811 -0.631 . . . . 538.07 111.737 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.13 84.14 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.061 -0.518 . . . . 282.7 111.609 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -60.04 -48.41 81.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.551 -0.295 . . . . 999.99 110.694 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -43.53 98.55 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.274 -0.421 . . . . 504.74 110.338 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -47.83 84.25 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.807 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.36 -40.31 93.83 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.252 -0.431 . . . . 558.87 110.899 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.03 99.85 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.409 -0.359 . . . . 412.73 110.924 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.34 -40.81 94.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.048 -0.524 . . . . 665.66 110.663 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.97 -42.6 99.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.816 -0.629 . . . . 999.99 111.13 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.66 -42.39 83.44 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.97 -0.559 . . . . 746.24 111.744 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.0 1.77 56.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.524 -0.307 . . . . 999.99 111.352 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 57.96 41.65 24.1 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.237 0.615 . . . . 848.93 111.925 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.95 81.63 2.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.935 0.397 . . . . 999.99 110.513 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.2 mt -93.84 118.61 67.36 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.503 . . . . 586.78 110.401 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.82 149.11 53.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.598 2.199 . . . . 310.73 112.717 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.71 135.92 33.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.242 -0.436 . . . . 866.09 110.436 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.73 109.36 3.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.357 . . . . 999.99 111.014 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.0 mt -97.23 125.08 46.98 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 579.24 111.237 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -55.47 -31.96 80.33 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.277 2.651 . . . . 684.25 113.051 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -62.12 -36.52 81.99 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.371 -0.377 . . . . 662.15 111.091 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 61.1 mtt -60.31 -38.73 84.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.449 -0.341 . . . . 999.99 110.319 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.11 -39.44 89.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.932 -0.576 . . . . 675.31 110.291 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' A' ' 124' ' ' MET . 97.9 mt-10 -64.03 -40.15 95.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.999 -0.546 . . . . 900.95 110.909 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.6 mt -61.42 -41.79 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.022 0.439 . . . . 500.83 110.45 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -60.33 -37.34 80.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 834.99 110.89 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -74.74 -10.85 59.91 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.077 -0.511 . . . . 999.99 112.335 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 65.4 mtt -77.38 119.91 21.66 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.982 -0.287 . . . . 599.62 110.786 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -52.98 120.72 20.34 Favored Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 116.015 -0.538 . . . . 999.99 112.012 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -58.92 -35.83 97.93 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.884 2.39 . . . . 214.74 112.827 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.32 -37.07 85.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.695 0.628 . . . . 248.66 112.695 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -90.84 -22.07 21.16 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.432 0.53 . . . . 360.37 112.432 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 62.0 t -105.34 109.02 62.73 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 121.028 -0.269 . . . . 334.76 110.774 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.85 138.98 85.99 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.476 2.117 . . . . 351.83 112.463 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.414 HG13 ' N ' ' A' ' 132' ' ' LYS . 96.6 t -128.54 137.7 56.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.127 -0.488 . . . . 410.42 111.31 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.414 ' N ' HG13 ' A' ' 131' ' ' VAL . 58.9 mtmt -122.9 147.72 46.27 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.218 -0.66 . . . . 999.99 109.218 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -83.52 125.72 32.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.727 0.298 . . . . 551.94 110.99 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.4 mtm . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.4 -0.81 . . . . 965.93 111.311 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.883 0.373 . . . . 999.99 110.74 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 m -103.43 97.25 7.33 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.837 -0.801 . . . . 999.99 108.837 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 34.7 p-90 -98.72 1.72 46.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.216 -0.447 . . . . 999.99 111.892 -178.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -149.73 148.89 29.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.702 -0.227 . . . . 999.99 110.461 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -65.62 -36.75 84.62 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.124 -0.489 . . . . 999.99 111.4 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.34 130.25 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.205 -0.452 . . . . 521.04 109.913 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -80.94 119.31 75.68 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.281 -0.418 . . . . 999.99 111.046 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -59.69 144.9 99.34 Favored 'Trans proline' 0 C--N 1.35 0.605 0 C-N-CA 122.973 2.449 . . . . 546.56 111.854 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -120.35 151.42 39.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.822 0.344 . . . . 999.99 111.733 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 63.36 29.17 15.7 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.291 -0.868 . . . . 999.99 112.605 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -57.99 128.22 36.02 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.641 0.258 . . . . 999.99 111.078 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -114.07 114.74 26.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.594 -0.276 . . . . 280.85 110.414 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.76 -39.39 94.0 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.635 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.91 87.6 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.409 -0.359 . . . . 200.79 111.642 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -68.37 -31.37 70.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 518.33 110.398 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.76 -39.91 95.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.909 -0.587 . . . . 524.44 110.679 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.8 t -62.13 -46.81 95.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.013 0.435 . . . . 407.88 110.86 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.513 ' O ' HG21 ' A' ' 21' ' ' VAL . . . -62.53 -39.57 93.99 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.626 -0.715 . . . . 136.03 110.596 179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.1 tp -64.27 -45.28 88.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.602 -0.726 . . . . 505.3 111.883 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -61.77 -40.75 96.27 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.259 0.837 . . . . 703.51 113.259 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 18' ' ' ALA . 34.4 m -66.65 -33.76 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.221 -0.591 . . . . 324.41 111.485 -179.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.05 -40.67 78.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.047 0.451 . . . . 685.46 109.898 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.15 -43.29 95.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 115.442 -0.799 . . . . 238.49 110.64 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -60.88 -43.27 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.839 -0.619 . . . . 509.15 111.276 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -43.32 98.49 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.618 0.229 . . . . 183.06 111.618 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.24 -42.28 97.95 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.881 -0.676 . . . . 63.82 112.733 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -74.7 -18.29 60.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.8 0.333 . . . . 351.91 111.505 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -75.73 -31.79 59.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.344 -0.389 . . . . 145.09 110.912 -178.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -60.76 -46.08 91.83 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.465 -0.569 . . . . 999.99 109.465 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.98 93.56 Favored Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.605 -0.725 . . . . 82.9 111.751 178.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.87 -48.27 82.59 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.428 -0.386 . . . . 392.81 111.655 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.89 -29.45 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 C-N-CA 120.929 -0.308 . . . . 455.7 111.214 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.509 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 64.2 tttm -62.41 -43.78 98.0 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.967 0.413 . . . . 756.66 110.423 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -70.22 -39.51 75.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.16 -0.473 . . . . 999.99 110.18 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.29 -38.42 91.09 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.619 0.6 . . . . 373.99 112.619 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -66.32 -19.17 65.74 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.885 -0.509 . . . . 811.35 111.431 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.11 -52.56 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 112.551 0.575 . . . . 461.27 112.551 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -111.6 -8.08 14.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.951 0.723 . . . . 575.93 112.951 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.82 -17.82 69.76 Favored Glycine 0 N--CA 1.46 0.241 0 C-N-CA 121.252 -0.499 . . . . 226.53 113.567 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -61.18 -39.37 89.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.752 0.31 . . . . 999.99 111.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -91.6 -8.22 47.92 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.688 0.625 . . . . 432.8 112.688 -179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.8 141.86 48.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.884 0.373 . . . . 844.62 111.509 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.9 p -77.59 168.44 19.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.068 -0.514 . . . . 316.62 110.375 178.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 87.0 m -60.9 -40.44 93.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.881 0.372 . . . . 291.13 110.713 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 61.8 t -65.6 -44.28 93.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.004 -0.543 . . . . 467.63 110.946 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -63.99 -41.57 97.47 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.422 -0.354 . . . . 430.34 111.232 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -62.89 -46.32 88.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.458 -0.337 . . . . 667.57 110.825 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -65.09 -40.72 94.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.118 -0.492 . . . . 527.8 110.909 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.19 78.95 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.859 -0.61 . . . . 169.13 111.499 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.01 -39.18 81.09 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.043 -0.526 . . . . 409.47 111.327 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -60.77 -40.17 91.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.701 0.286 . . . . 686.82 110.527 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.51 ' HB2' ' SD ' ' A' ' 118' ' ' MET . 61.4 t80 -66.39 -39.75 89.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.219 -0.446 . . . . 213.85 109.887 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.7 t -60.99 -43.86 96.95 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.712 -0.676 . . . . 289.44 110.025 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.68 -40.4 91.99 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.903 -0.59 . . . . 358.19 109.98 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 58' ' ' MET . 77.4 ttt-85 -60.35 -47.91 84.01 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.808 -0.633 . . . . 999.99 110.757 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.4 mmm-85 -64.59 -40.77 96.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.098 0.475 . . . . 999.99 110.793 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -62.51 -48.16 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.663 -0.698 . . . . 212.58 112.48 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.494 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 4.9 ppp? -64.36 -38.37 90.79 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.172 0.804 . . . . 262.65 113.172 -178.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.41 -39.14 71.3 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.482 -0.487 . . . . 684.75 111.78 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.6 p -73.82 -41.33 62.47 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 111.72 0.267 . . . . 450.86 111.72 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -63.76 -45.87 87.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.834 0.35 . . . . 587.54 110.427 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -62.38 -47.56 83.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.896 -0.593 . . . . 785.5 111.729 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.73 88.33 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.502 -0.317 . . . . 290.18 111.709 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -61.41 -46.87 88.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.838 0.351 . . . . 676.15 110.709 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.51 -46.7 84.85 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 824.3 110.865 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.5 mmm -52.04 -19.66 2.0 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.183 1.179 . . . . 839.61 114.183 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.0 mt -59.77 -43.59 94.27 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 118.257 0.481 . . . . 667.86 110.587 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -68.43 -45.54 72.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.03 -0.532 . . . . 999.99 111.271 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.0 mm -67.95 -41.11 84.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 115.465 -0.789 . . . . 648.32 112.787 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -59.2 -39.15 81.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.052 0.39 . . . . 555.82 112.052 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.83 -42.28 97.42 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 121.042 -0.263 . . . . 912.86 110.955 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.29 -42.06 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.528 -0.306 . . . . 999.99 111.64 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.67 -47.99 88.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.53 -0.305 . . . . 322.08 111.291 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.31 -40.32 97.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.219 -0.446 . . . . 443.19 111.504 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.31 -40.74 96.54 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.495 -0.32 . . . . 427.97 111.51 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.26 -40.28 77.92 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.817 0.341 . . . . 552.67 111.279 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.05 -8.48 79.75 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.978 -0.63 . . . . 282.78 112.776 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.6 mmt180 -74.57 145.63 43.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.61 0.243 . . . . 999.99 111.063 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 79.8 p -72.14 138.12 81.77 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.436 -0.347 . . . . 423.41 110.845 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 36.1 Cg_exo -61.51 135.36 56.62 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.537 2.158 . . . . 262.13 112.842 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.2 p -104.07 150.58 7.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.467 -0.333 . . . . 322.52 110.235 178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.93 -42.07 95.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 111.974 0.361 . . . . 195.73 111.974 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.23 -43.13 97.42 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 120.906 -0.664 . . . . 116.64 113.546 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.89 -43.02 97.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.03 0.443 . . . . 397.23 110.435 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -64.42 -41.12 96.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.545 -0.752 . . . . 273.3 111.774 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.5 p -67.91 -36.19 79.76 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 121.011 -0.276 . . . . 391.43 111.306 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -62.61 -45.99 90.34 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.223 0.535 . . . . 999.99 109.639 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.72 -39.8 91.54 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.42 -0.809 . . . . 292.18 110.53 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.67 -39.71 97.78 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.633 -0.712 . . . . 65.97 112.771 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.71 94.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.651 0.262 . . . . 184.99 110.971 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -65.54 -40.65 93.12 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.144 0.497 . . . . 381.14 110.522 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.2 mm -65.52 -41.79 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.461 -0.791 . . . . 354.06 111.21 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.41 -16.96 61.32 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.899 -0.592 . . . . 88.8 113.707 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -79.78 -13.92 59.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 117.034 0.417 . . . . 999.99 111.362 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -108.58 119.81 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.772 0.32 . . . . 999.99 110.433 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.2 pt -129.82 156.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 458.46 111.483 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -136.21 21.62 3.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.344 0.592 . . . . 388.05 109.974 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.5 mtp -64.54 -39.48 93.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.324 -0.853 . . . . 538.07 112.23 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.98 -40.88 97.11 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.246 0.461 . . . . 282.7 112.246 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -78.5 -21.6 48.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.594 -0.275 . . . . 999.99 111.687 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -59.46 -46.76 87.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.474 -0.33 . . . . 504.74 111.013 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -62.0 -39.44 92.24 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.697 0.284 . . . . 999.99 110.902 179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -62.59 -42.72 99.73 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.112 -0.495 . . . . 558.87 110.23 179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.23 -40.24 95.47 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.802 -0.635 . . . . 412.73 111.092 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -62.55 -42.12 99.34 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.355 -0.384 . . . . 665.66 110.835 179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.66 -44.0 97.37 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.279 -0.419 . . . . 999.99 110.976 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.89 -39.92 82.85 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.032 -0.531 . . . . 746.24 111.935 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.17 -2.23 56.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.527 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.2 t30 56.66 43.71 24.99 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 123.64 0.588 . . . . 848.93 111.299 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 78.9 mtm -103.85 111.16 23.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.368 . . . . 999.99 111.371 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 72.3 mt -94.67 118.92 66.79 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 586.78 109.996 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.83 118.88 5.77 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.159 1.906 . . . . 310.73 112.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.75 142.88 28.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 866.09 110.623 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -67.36 125.78 27.18 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.721 0.296 . . . . 999.99 110.906 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.2 mt -99.53 144.7 28.78 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.269 -0.423 . . . . 579.24 110.87 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.25 -18.89 50.72 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.667 2.245 . . . . 684.25 112.056 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -62.61 -26.67 68.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.475 -0.784 . . . . 662.15 111.358 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' MET . . . . . 0.51 ' SD ' ' HB2' ' A' ' 52' ' ' PHE . 93.9 mmm -59.88 -38.92 83.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.256 -0.429 . . . . 999.99 111.529 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.88 -40.87 94.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.573 -0.285 . . . . 675.31 110.73 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -65.35 -40.98 94.3 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.429 -0.35 . . . . 900.95 111.181 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 28.6 mm -61.91 -45.02 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.384 -0.371 . . . . 500.83 111.08 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.12 -39.69 95.43 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.024 0.379 . . . . 834.99 112.024 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -70.19 -33.18 71.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.7 mtm -88.06 132.93 34.1 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.535 0.569 . . . . 599.62 112.535 -178.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.509 ' O ' HG22 ' A' ' 129' ' ' VAL . 40.9 mmt180 -53.77 145.54 30.68 Favored Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.586 -0.734 . . . . 999.99 110.874 178.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.61 -30.06 90.97 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.671 2.247 . . . . 214.74 112.884 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.73 -36.03 81.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.233 -0.439 . . . . 248.66 111.234 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -91.98 0.48 57.47 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.552 0.575 . . . . 360.37 112.552 -178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 125' ' ' ARG . 66.3 t -83.13 116.6 65.15 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 334.76 110.964 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.56 156.34 49.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.821 2.348 . . . . 351.83 112.696 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 m -129.61 159.93 41.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.13 -0.486 . . . . 410.42 110.564 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -118.12 136.04 53.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.976 0.417 . . . . 999.99 111.521 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.3 165.64 18.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 551.94 110.349 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 3.4 mtt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.158 -0.925 . . . . 965.93 111.082 -179.285 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 120.773 0.32 . . . . 999.99 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.8 m -110.18 108.89 19.2 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.169 -0.678 . . . . 999.99 109.169 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 -113.32 -141.55 0.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.559 -0.292 . . . . 999.99 110.803 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.4 m170 68.02 -118.8 0.19 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.408 0.442 . . . . 999.99 110.568 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 63.27 -92.16 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.867 0.467 . . . . 999.99 111.632 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.0 t -119.72 127.55 75.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.815 0.341 . . . . 521.04 110.809 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -90.2 120.39 69.17 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 999.99 110.341 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.28 147.73 53.85 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.661 2.241 . . . . 546.56 112.906 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -157.16 -25.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.047 -0.524 . . . . 999.99 111.579 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -87.19 -12.63 46.3 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.288 0.477 . . . . 999.99 112.288 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.63 139.25 54.09 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.099 0.476 . . . . 999.99 112.036 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -100.52 123.57 44.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.771 -0.65 . . . . 280.85 110.008 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.45 -38.82 88.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.466 . . . . 999.99 111.282 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.77 86.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.404 -0.362 . . . . 200.79 111.562 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -68.51 -32.7 72.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 518.33 110.061 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -64.47 -38.62 91.65 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.8 -0.637 . . . . 524.44 110.018 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.71 -45.12 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 115.663 -0.699 . . . . 407.88 110.724 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.11 94.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 136.03 110.68 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.81 -38.59 89.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.899 -0.591 . . . . 505.3 111.566 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -60.61 -38.19 83.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.207 -0.452 . . . . 703.51 111.695 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.95 -43.6 99.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 324.41 110.43 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.76 -41.48 97.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.208 -0.451 . . . . 685.46 110.767 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.653 HG23 ' SD ' ' A' ' 58' ' ' MET . 94.6 mt -64.41 -43.54 97.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.876 -0.602 . . . . 238.49 110.88 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.32 -40.81 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.726 -0.67 . . . . 509.15 111.64 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.85 -43.32 94.69 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.631 0.234 . . . . 183.06 111.631 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.41 -42.62 97.56 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.677 -0.773 . . . . 63.82 112.537 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -72.41 -19.91 61.52 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 111.97 0.359 . . . . 351.91 111.97 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -31.96 58.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.612 -0.267 . . . . 145.09 111.263 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 41.0 mmt180 -61.57 -42.48 98.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.894 0.378 . . . . 999.99 110.176 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.17 70.18 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.992 -0.549 . . . . 82.9 112.195 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -60.71 -46.27 91.03 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.341 0.497 . . . . 392.81 112.341 -178.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.1 m -68.72 -26.68 33.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 112.37 0.507 . . . . 455.7 112.37 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 48.5 mmtm -63.6 -43.12 97.84 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.711 0.291 . . . . 756.66 111.072 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -81.14 -28.06 35.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.732 0.301 . . . . 999.99 111.128 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.84 -43.87 97.7 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.851 -0.613 . . . . 373.99 111.537 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -70.89 -20.87 62.46 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.822 0.304 . . . . 811.35 111.822 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG21 ' O ' ' A' ' 33' ' ' LYS . 89.8 t -87.59 -49.75 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.498 0.555 . . . . 461.27 112.498 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.47 8.75 41.93 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.449 0.537 . . . . 575.93 112.449 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.86 -38.9 96.08 Favored Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.333 -0.461 . . . . 226.53 113.719 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.7 ptm180 -64.43 -23.65 67.36 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.493 0.553 . . . . 999.99 112.493 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.5 p -112.36 1.99 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.085 0.402 . . . . 432.8 112.085 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.0 tp -72.52 124.4 25.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.348 . . . . 844.62 111.21 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.6 m -77.93 156.36 30.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 316.62 110.858 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.4 m -61.08 -42.84 99.24 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.376 -0.375 . . . . 291.13 111.013 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 66.7 t -66.09 -42.07 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 116.166 -0.47 . . . . 467.63 110.597 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -62.98 -40.52 97.98 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.066 -0.516 . . . . 430.34 111.222 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.76 -47.71 85.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.43 -0.35 . . . . 667.57 110.995 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.24 -40.8 90.48 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.879 0.371 . . . . 527.8 110.953 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.63 93.91 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.796 -0.638 . . . . 169.13 111.881 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.3 -39.54 83.34 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.225 -0.443 . . . . 409.47 112.12 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -62.75 -43.4 98.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.884 -0.326 . . . . 686.82 110.232 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.62 -48.23 80.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.956 -0.565 . . . . 213.85 110.526 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.76 -42.19 93.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-N 115.52 -0.764 . . . . 289.44 111.408 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -58.89 -45.77 89.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.688 -0.233 . . . . 358.19 111.456 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.405 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 89.0 mtm180 -65.1 -42.13 94.33 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.943 -0.303 . . . . 999.99 111.211 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.97 -40.94 95.75 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.214 0.531 . . . . 999.99 110.57 178.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -61.21 -46.3 91.02 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.295 -0.866 . . . . 212.58 110.415 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.653 ' SD ' HG23 ' A' ' 23' ' ' ILE . 42.3 ttp -60.43 -40.07 89.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.617 -0.719 . . . . 262.65 110.998 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 76.6 mt-30 -61.99 -39.79 93.44 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 112.584 0.587 . . . . 684.75 112.584 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 74.1 p -65.51 -41.74 92.84 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.681 -0.408 . . . . 450.86 111.584 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 77.9 m-70 -71.06 -40.14 71.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.859 0.362 . . . . 587.54 110.775 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.452 ' O ' ' HG2' ' A' ' 66' ' ' MET . 69.3 t-105 -62.12 -46.02 90.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.882 -0.599 . . . . 785.5 110.944 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -39.91 83.56 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.22 -0.445 . . . . 290.18 111.567 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -60.6 -45.4 94.13 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.269 -0.423 . . . . 676.15 111.005 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 57.1 m-85 -68.45 -39.29 81.52 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.269 -0.423 . . . . 824.3 111.199 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 62' ' ' TRP . 92.9 mmm -55.24 -41.17 71.76 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.413 0.523 . . . . 839.61 112.413 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.72 -47.71 84.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.826 0.346 . . . . 667.86 110.473 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.2 t90 -64.96 -45.94 83.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.071 -0.513 . . . . 999.99 110.828 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.6 -46.82 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.734 -0.666 . . . . 648.32 111.89 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -61.86 -40.97 97.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.831 -0.168 . . . . 555.82 111.435 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -62.45 -45.88 91.06 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.442 -0.345 . . . . 912.86 110.657 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -62.11 -46.55 88.53 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.019 -0.537 . . . . 999.99 111.075 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.93 -44.25 99.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.1 -0.5 . . . . 322.08 111.118 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -60.43 -44.18 96.05 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.344 -0.389 . . . . 443.19 111.222 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.48 97.17 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.492 -0.322 . . . . 427.97 111.476 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.01 -40.34 75.31 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.364 -0.38 . . . . 552.67 111.494 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.61 -4.91 85.08 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 116.068 -0.515 . . . . 282.78 112.351 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -75.6 154.71 36.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 999.99 111.435 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.7 p -110.44 95.68 23.67 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 423.41 110.394 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.77 151.89 57.93 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.799 2.333 . . . . 262.13 113.703 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.6 m -100.79 -176.5 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.605 -0.725 . . . . 322.52 110.863 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.9 t -60.03 -42.24 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.384 -0.371 . . . . 195.73 111.01 -179.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.05 96.12 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.848 -0.692 . . . . 116.64 112.814 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.52 -41.89 96.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.078 0.466 . . . . 397.23 110.348 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -67.14 -37.56 84.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.611 -0.722 . . . . 273.3 112.032 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 70.3 p -64.96 -28.54 69.59 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.376 0.51 . . . . 391.43 112.376 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.3 ttp-105 -61.85 -46.35 89.81 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.579 -0.526 . . . . 999.99 109.579 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.83 -40.08 83.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.545 -0.752 . . . . 292.18 110.393 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.78 98.22 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.605 -0.725 . . . . 65.97 112.902 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.15 -40.61 94.5 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.543 0.211 . . . . 184.99 111.097 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.76 -40.23 94.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.271 -0.422 . . . . 381.14 110.408 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.69 -43.64 98.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.854 -0.612 . . . . 354.06 110.558 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.97 -21.21 65.43 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.884 -0.598 . . . . 88.8 113.447 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 85.7 mtp180 -80.14 -17.04 53.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.892 0.346 . . . . 999.99 111.196 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -109.2 112.73 25.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 999.99 110.725 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.3 pt -130.3 156.22 42.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.877 0.37 . . . . 458.46 111.079 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -141.01 34.12 1.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.247 0.546 . . . . 388.05 110.094 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 99.2 mtp -66.77 -34.26 77.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.427 -0.806 . . . . 538.07 111.578 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.6 -38.32 80.95 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.253 -0.431 . . . . 282.7 110.941 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.1 -42.0 93.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.636 -0.711 . . . . 999.99 110.59 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -58.02 -47.33 83.39 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.967 -0.56 . . . . 504.74 111.505 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -60.41 -42.9 96.95 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.625 0.25 . . . . 999.99 110.939 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.69 -45.47 78.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.292 -0.413 . . . . 558.87 110.956 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.22 -40.18 96.73 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.866 -0.606 . . . . 412.73 112.088 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.59 -49.4 77.67 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.516 -0.311 . . . . 665.66 110.705 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -63.7 -39.27 93.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.814 0.34 . . . . 999.99 111.093 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.96 -39.88 79.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.921 -0.582 . . . . 746.24 111.817 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -82.55 -11.29 58.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.896 0.332 . . . . 999.99 111.896 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 53.51 43.03 31.81 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.394 0.434 . . . . 848.93 111.79 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -118.27 121.61 40.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.746 0.308 . . . . 999.99 110.52 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.3 mt -94.66 116.42 66.37 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.421 -0.354 . . . . 586.78 110.226 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.56 136.41 71.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.651 2.234 . . . . 310.73 112.617 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -85.46 134.42 34.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 866.09 110.579 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -68.24 116.99 9.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.795 0.331 . . . . 999.99 110.551 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.9 mt -99.38 147.67 33.64 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.404 . . . . 579.24 110.772 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.03 -28.61 66.0 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.542 2.161 . . . . 684.25 112.098 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.23 -37.91 89.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.861 -0.609 . . . . 662.15 110.813 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.0 mtt -59.6 -42.05 91.69 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-N 116.049 -0.523 . . . . 999.99 110.4 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -61.81 -44.72 96.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.125 -0.489 . . . . 675.31 110.817 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.63 -45.05 88.49 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.899 -0.592 . . . . 900.95 112.462 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.412 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 17.8 tt -72.91 -25.18 21.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 120.735 0.302 . . . . 500.83 111.719 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.13 -37.99 87.24 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.97 0.414 . . . . 834.99 111.139 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -85.44 -0.7 55.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 999.99 111.785 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.412 ' SD ' ' HA ' ' A' ' 121' ' ' ILE . 99.0 mtp -90.15 125.66 35.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.606 0.241 . . . . 599.62 111.291 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 129' ' ' VAL . 99.5 mtt180 -53.19 141.48 40.63 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-N 115.982 -0.554 . . . . 999.99 111.035 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.56 -36.63 81.2 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.982 2.454 . . . . 214.74 112.715 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.6 -34.86 76.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.923 -0.58 . . . . 248.66 111.781 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.85 0.27 57.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.229 0.455 . . . . 360.37 112.229 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 125' ' ' ARG . 63.3 t -85.57 117.02 67.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.749 0.309 . . . . 334.76 110.624 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.35 155.58 55.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.573 2.182 . . . . 351.83 112.889 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.5 t -113.77 136.86 48.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 410.42 109.843 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -115.49 131.49 56.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.85 0.357 . . . . 999.99 111.317 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -81.35 152.23 27.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 551.94 110.565 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.7 mtp . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.22 -0.895 . . . . 965.93 110.667 -179.699 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 49.8 mmm-85 . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 120.548 0.213 . . . . 999.99 111.306 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m 54.41 -118.52 1.32 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.876 -0.602 . . . . 999.99 111.558 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.5 174.49 14.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.415 . . . . 999.99 109.878 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 55.6 m170 -105.17 166.39 10.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.798 0.332 . . . . 999.99 111.308 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -67.87 -28.21 67.34 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.828 -0.624 . . . . 999.99 110.722 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.9 t -99.89 131.46 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.749 -0.659 . . . . 521.04 109.653 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 46.3 mp0 -80.21 121.33 81.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 999.99 110.77 -178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 47.8 Cg_exo -60.23 141.91 97.03 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.002 2.468 . . . . 546.56 112.709 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -74.36 143.94 44.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.511 . . . . 999.99 110.295 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -91.23 102.91 15.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.936 0.398 . . . . 999.99 110.718 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.0 mp -57.82 149.66 21.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.638 -0.71 . . . . 999.99 111.509 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -65.2 145.73 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.877 -0.416 . . . . 280.85 109.877 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.25 -45.14 91.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.615 -0.266 . . . . 999.99 111.187 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.35 88.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.5 -0.318 . . . . 200.79 111.615 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -67.89 -35.22 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 518.33 110.213 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 95.8 mt-10 -65.18 -38.9 91.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.822 -0.626 . . . . 524.44 110.161 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.1 -45.6 95.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.823 -0.626 . . . . 407.88 111.104 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.12 98.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.898 -0.592 . . . . 136.03 111.001 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.5 mt -69.05 -38.85 79.35 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.939 -0.573 . . . . 505.3 111.948 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 62.4 mtpt -60.74 -39.37 88.43 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.39 0.515 . . . . 703.51 112.39 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.81 -44.66 99.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.709 0.29 . . . . 324.41 110.841 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.96 -40.29 91.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.415 -0.357 . . . . 685.46 111.335 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.88 -45.05 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 120.918 0.39 . . . . 238.49 110.829 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.96 -42.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 115.886 -0.597 . . . . 509.15 111.323 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.32 95.72 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 121.115 -0.234 . . . . 183.06 111.138 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.72 -42.6 95.2 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.81 -0.71 . . . . 63.82 112.653 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.428 ' O ' ' HE2' ' A' ' 98' ' ' MET . 9.8 m-30 -71.61 -19.61 62.09 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.626 0.37 . . . . 351.91 111.916 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.39 -29.01 56.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.828 -0.169 . . . . 145.09 110.887 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.59 -40.56 97.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 999.99 110.56 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.21 -29.53 40.7 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.703 -0.76 . . . . 82.9 112.492 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.5 -43.13 95.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.927 0.343 . . . . 392.81 111.927 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -64.72 -26.09 39.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 112.388 0.514 . . . . 455.7 112.388 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.84 -43.12 99.49 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.551 0.215 . . . . 756.66 110.85 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -72.2 -35.78 69.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.061 0.457 . . . . 999.99 110.439 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 93.0 mt -62.91 -38.43 90.91 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.524 -0.762 . . . . 373.99 111.555 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -68.88 -24.02 64.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.661 0.245 . . . . 811.35 111.661 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.6 t -85.75 -46.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 112.233 0.457 . . . . 461.27 112.233 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -101.29 8.51 42.4 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.421 0.526 . . . . 575.93 112.421 -178.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.48 -26.54 69.72 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 121.483 -0.389 . . . . 226.53 113.827 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -61.61 -40.2 93.97 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.772 0.286 . . . . 999.99 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.0 p -112.96 14.18 19.65 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.037 0.384 . . . . 432.8 112.037 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.4 tp -71.12 123.53 22.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.983 0.42 . . . . 844.62 111.515 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.4 m -79.59 159.98 26.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.966 -0.561 . . . . 316.62 110.865 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.7 m -60.92 -44.98 96.44 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.335 -0.393 . . . . 291.13 111.456 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.3 m -71.03 -29.44 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 112.256 0.465 . . . . 467.63 112.256 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.69 -40.08 94.77 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 121.216 -0.194 . . . . 430.34 110.987 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.9 tttp -61.38 -46.68 89.19 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.86 0.362 . . . . 667.57 110.136 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.953 -0.567 . . . . 527.8 110.649 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.54 90.52 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 115.848 -0.615 . . . . 169.13 110.755 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.05 -39.12 93.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.084 -0.507 . . . . 409.47 111.336 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.475 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 43.4 m-85 -63.18 -38.94 93.17 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 109.249 -0.648 . . . . 686.82 109.249 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -61.09 -47.57 85.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.454 -0.793 . . . . 213.85 109.678 177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.5 t -62.86 -41.94 94.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 115.991 -0.55 . . . . 289.44 110.288 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -59.43 -43.1 93.14 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.949 -0.569 . . . . 358.19 111.053 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 48.2 ttp180 -61.04 -46.97 88.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.824 0.345 . . . . 999.99 110.508 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -62.74 -44.57 95.86 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.974 -0.557 . . . . 999.99 110.464 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.22 -48.11 83.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.505 -0.77 . . . . 212.58 111.232 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 43.9 ttp -60.74 -45.67 93.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.202 -0.453 . . . . 262.65 111.379 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -64.82 -41.12 96.02 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.062 -0.255 . . . . 684.75 111.063 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -63.68 -45.94 87.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.374 -0.375 . . . . 450.86 110.693 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -62.55 -46.28 89.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.894 -0.594 . . . . 587.54 110.132 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -61.51 -47.76 84.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.818 -0.628 . . . . 785.5 111.304 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.498 ' O ' HD13 ' A' ' 67' ' ' LEU . . . -59.61 -43.93 93.57 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.419 0.525 . . . . 290.18 112.419 -179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -43.38 96.79 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.187 -0.301 . . . . 676.15 110.187 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -65.44 -44.26 87.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.185 -0.461 . . . . 824.3 110.185 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 tpt -53.53 -45.35 69.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.428 -0.805 . . . . 839.61 111.806 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 63' ' ' ALA . 7.2 mp -60.88 -40.92 94.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.657 0.243 . . . . 667.86 111.657 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -63.04 -47.2 84.04 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.398 -0.364 . . . . 999.99 111.758 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 44.8 pt -77.44 -23.05 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.259 0.466 . . . . 648.32 112.259 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -58.99 -39.24 81.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.464 -0.335 . . . . 555.82 111.414 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.99 -43.26 99.12 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.665 0.269 . . . . 912.86 110.753 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -66.0 -45.08 82.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.255 -0.429 . . . . 999.99 110.758 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 37.8 mm -62.85 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.816 -0.629 . . . . 322.08 111.327 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -62.04 -43.61 98.46 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.31 -0.404 . . . . 443.19 111.368 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.45 97.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.498 -0.319 . . . . 427.97 111.462 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.15 -40.67 78.07 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.894 0.378 . . . . 552.67 111.168 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.91 -9.77 75.29 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.053 -0.521 . . . . 282.78 112.675 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -75.26 147.79 39.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.377 . . . . 999.99 111.338 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 12.1 p -102.02 106.3 46.92 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 423.41 110.51 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.11 145.4 49.33 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.628 2.219 . . . . 262.13 113.473 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.7 m -101.66 -175.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 322.52 111.236 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.61 -40.58 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.333 -0.394 . . . . 195.73 110.81 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.619 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.09 -40.29 96.92 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.889 -0.672 . . . . 116.64 112.641 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.9 -42.66 80.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.086 0.469 . . . . 397.23 110.612 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -68.2 -35.49 78.07 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.856 -0.611 . . . . 273.3 112.236 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.619 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -59.8 -34.64 73.3 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.453 0.168 . . . . 391.43 111.453 -179.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.98 -41.16 95.67 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.062 0.458 . . . . 999.99 109.898 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.22 -39.81 78.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.494 -0.776 . . . . 292.18 110.265 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -39.52 97.69 Favored Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.421 -0.809 . . . . 65.97 112.535 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.18 92.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.596 0.236 . . . . 184.99 110.67 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -64.78 -40.43 95.24 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.102 -0.499 . . . . 381.14 110.25 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.65 -43.24 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.639 -0.71 . . . . 354.06 110.589 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.72 -22.37 64.07 Favored Glycine 0 CA--C 1.52 0.394 0 CA-C-N 115.895 -0.593 . . . . 88.8 113.429 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.5 mmt-85 -80.08 -18.56 49.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.896 0.348 . . . . 999.99 111.191 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.1 mmt85 -108.47 111.98 24.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 999.99 110.379 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 60.4 mt -124.66 126.17 71.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.844 -0.428 . . . . 458.46 109.844 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.35 32.23 5.71 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.971 -0.292 . . . . 388.05 111.633 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.428 ' HE2' ' O ' ' A' ' 27' ' ' PHE . 77.7 mtm -70.0 -28.73 65.74 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.556 -0.293 . . . . 538.07 111.039 179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.79 -37.96 80.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.016 -0.538 . . . . 282.7 110.777 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -59.83 -42.21 93.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.665 -0.698 . . . . 999.99 110.368 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.94 -46.78 84.53 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.821 -0.627 . . . . 504.74 111.12 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -60.12 -44.37 94.95 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.536 0.208 . . . . 999.99 110.799 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.21 -42.74 93.18 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.455 -0.339 . . . . 558.87 111.126 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.85 96.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.063 -0.517 . . . . 412.73 111.574 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.97 -46.22 90.21 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.887 -0.597 . . . . 665.66 110.852 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.73 -39.31 93.98 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.307 -0.406 . . . . 999.99 111.352 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.73 -38.91 79.41 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.196 -0.456 . . . . 746.24 111.879 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -83.09 -11.65 57.8 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.601 -0.272 . . . . 999.99 111.385 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 54.98 39.89 31.8 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.563 0.539 . . . . 848.93 111.615 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.2 ttp -107.72 124.0 49.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.337 -0.392 . . . . 999.99 110.874 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.3 mt -94.11 117.12 67.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.378 -0.374 . . . . 586.78 110.373 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -59.78 142.02 97.89 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.821 2.347 . . . . 310.73 112.421 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -84.79 119.49 25.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 866.09 110.403 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -70.07 116.5 10.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.058 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.701 ' O ' ' HG2' ' A' ' 118' ' ' MET . 3.4 mm? -99.04 129.96 28.45 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.488 . . . . 579.24 111.243 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -58.5 -31.9 95.3 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.733 2.289 . . . . 684.25 112.565 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -61.22 -40.89 95.68 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.931 0.715 . . . . 662.15 112.931 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' MET . . . . . 0.701 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 24.8 ptt? -55.39 -22.46 19.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.551 0.575 . . . . 999.99 112.551 -178.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.13 -39.09 88.7 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.144 0.497 . . . . 675.31 110.337 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -67.75 -37.23 81.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.755 -0.657 . . . . 900.95 111.147 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.2 mt -60.34 -46.25 95.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.761 0.652 . . . . 500.83 112.761 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -80.46 -9.84 59.75 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.208 -0.597 . . . . 834.99 111.232 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -87.98 -32.77 18.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.822 0.344 . . . . 999.99 110.923 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 ptp -77.7 148.32 35.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.032 0.444 . . . . 599.62 111.855 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 42.5 ttm105 -51.96 128.69 37.96 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-N 115.371 -0.831 . . . . 999.99 111.572 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.19 -35.32 90.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.096 2.531 . . . . 214.74 112.895 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.13 -24.14 67.76 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.119 -0.491 . . . . 248.66 112.117 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.73 -0.93 57.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.622 -0.263 . . . . 360.37 111.563 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.2 t -88.0 119.23 70.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.688 0.28 . . . . 334.76 110.829 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.17 156.98 58.52 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.826 2.351 . . . . 351.83 112.749 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.9 t -118.73 137.45 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.057 -0.52 . . . . 410.42 110.53 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -114.57 129.79 56.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.505 -0.316 . . . . 999.99 110.425 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -82.69 75.28 9.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.938 0.399 . . . . 551.94 110.91 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.5 mtm . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.25 -0.881 . . . . 965.93 110.995 179.767 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 71.4 mtt85 . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 120.818 0.342 . . . . 999.99 110.335 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 m -92.11 -2.01 56.85 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.081 0.4 . . . . 999.99 112.081 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -102.78 129.45 49.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.812 0.339 . . . . 999.99 110.866 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -111.0 15.43 21.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 999.99 111.209 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -107.62 -111.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.463 -0.335 . . . . 999.99 110.73 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.1 m -129.67 153.87 39.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.751 0.31 . . . . 521.04 110.659 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -81.15 156.97 71.52 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.447 . . . . 999.99 110.829 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.78 139.76 90.04 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.639 2.226 . . . . 546.56 111.933 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -121.86 -51.26 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.868 0.322 . . . . 999.99 111.868 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -101.02 3.22 41.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.81 0.3 . . . . 999.99 111.81 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.97 113.62 1.97 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.826 0.346 . . . . 999.99 111.492 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -114.24 152.07 31.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 280.85 110.969 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.34 -41.72 97.51 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.218 -0.446 . . . . 999.99 110.557 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.56 -38.79 82.06 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.932 -0.576 . . . . 200.79 111.405 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -63.08 -37.98 89.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 518.33 109.876 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.21 -44.07 96.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.855 -0.611 . . . . 524.44 110.271 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.89 -45.81 97.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.609 -0.723 . . . . 407.88 111.242 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.19 90.63 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.058 -0.519 . . . . 136.03 111.164 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.1 mt -62.02 -42.37 99.09 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.35 -0.386 . . . . 505.3 110.715 178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.407 ' O ' HG12 ' A' ' 24' ' ' ILE . 31.7 mmmt -61.98 -39.81 93.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.383 -0.371 . . . . 703.51 111.353 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 76.4 t -64.0 -46.64 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.669 -0.241 . . . . 324.41 110.994 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -68.41 -42.72 78.56 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.907 0.384 . . . . 685.46 111.034 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.41 ' O ' ' HD1' ' A' ' 27' ' ' PHE . 83.6 mt -63.8 -46.73 93.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.728 -0.669 . . . . 238.49 112.432 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.407 HG12 ' O ' ' A' ' 20' ' ' LYS . 30.1 mm -61.02 -45.98 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 121.044 -0.263 . . . . 509.15 111.058 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.51 92.28 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.768 0.285 . . . . 183.06 111.768 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.52 -45.25 90.78 Favored Glycine 0 C--N 1.335 0.521 0 C-N-CA 120.938 -0.649 . . . . 63.82 113.683 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.41 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 46.6 m-85 -73.2 -20.79 60.8 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.017 0.377 . . . . 351.91 112.017 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.51 ' O ' HG22 ' A' ' 32' ' ' VAL . 35.0 t70 -75.9 -38.14 58.07 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.827 -0.17 . . . . 145.09 111.17 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 tpp85 -60.56 -45.82 92.49 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.833 -0.432 . . . . 999.99 109.833 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.435 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.47 -40.09 98.2 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.761 -0.654 . . . . 82.9 112.387 178.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.33 -39.46 94.61 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.573 0.225 . . . . 392.81 111.122 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 28' ' ' ASP . 57.6 t -59.8 -40.09 81.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.137 -0.483 . . . . 455.7 111.76 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.17 -41.6 93.17 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 111.653 0.242 . . . . 756.66 111.653 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.435 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 7.3 m-90 -80.74 -36.95 31.37 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.687 0.28 . . . . 999.99 111.49 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.8 mt -64.74 -38.37 90.75 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.536 0.569 . . . . 373.99 112.536 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -64.13 -18.82 64.8 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.449 0.537 . . . . 811.35 112.449 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.1 t -84.71 -42.92 17.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.741 0.305 . . . . 461.27 111.699 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -104.25 11.96 34.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.753 0.311 . . . . 575.93 111.555 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.18 -20.14 68.87 Favored Glycine 0 CA--C 1.517 0.195 0 CA-C-N 116.049 -0.523 . . . . 226.53 114.359 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -61.31 -40.84 95.67 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.038 0.419 . . . . 999.99 111.662 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.6 p -113.4 9.99 18.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.911 0.338 . . . . 432.8 111.911 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.6 tp -71.75 123.35 22.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.986 0.422 . . . . 844.62 111.946 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.5 m -79.77 157.93 26.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 316.62 110.454 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 94.2 m -60.93 -44.36 97.34 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.803 0.335 . . . . 291.13 111.183 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.39 -31.75 52.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.263 -0.426 . . . . 467.63 112.068 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.92 -41.97 90.7 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.867 0.365 . . . . 430.34 110.282 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.7 tttp -62.86 -46.42 87.95 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.808 -0.633 . . . . 667.57 110.229 178.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.419 ' O ' ' HE2' ' A' ' 118' ' ' MET . 55.2 mtpt -63.18 -40.72 98.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.395 -0.821 . . . . 527.8 111.252 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.37 95.71 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.169 -0.469 . . . . 169.13 111.626 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.444 ' HA ' HD22 ' A' ' 50' ' ' LEU . 88.2 mt -64.25 -39.11 93.28 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.29 -0.414 . . . . 409.47 112.0 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.495 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 36.3 m-85 -63.5 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.829 -0.434 . . . . 686.82 109.829 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -62.27 -47.14 85.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.622 -0.717 . . . . 213.85 111.341 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.25 -26.81 23.04 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 C-N-CA 120.5 -0.48 . . . . 289.44 111.366 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.12 -44.36 96.81 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.859 0.362 . . . . 358.19 110.307 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtm-85 -64.99 -38.64 91.62 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.875 -0.602 . . . . 999.99 110.975 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -60.24 -45.39 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.33 -0.395 . . . . 999.99 109.973 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -59.63 -47.7 84.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.893 -0.594 . . . . 212.58 110.437 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -59.99 -46.18 90.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 262.65 111.263 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -62.82 -40.96 99.01 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 112.034 0.383 . . . . 684.75 112.034 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.9 p -69.91 -39.34 76.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.84 -0.344 . . . . 450.86 111.476 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -71.98 -42.82 66.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.901 0.381 . . . . 587.54 110.79 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -62.59 -40.17 96.04 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.83 -0.623 . . . . 785.5 111.961 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.84 -40.81 80.95 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.096 0.406 . . . . 290.18 112.096 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -63.66 -42.24 98.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.691 0.281 . . . . 676.15 111.03 179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.06 -39.96 68.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.401 -0.363 . . . . 824.3 111.344 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 tpt -52.53 -43.09 64.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.81 -0.632 . . . . 839.61 112.16 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.67 -43.54 98.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.675 -0.239 . . . . 667.86 111.281 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.22 -40.03 78.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.942 0.401 . . . . 999.99 110.855 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -63.14 -44.97 99.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.759 -0.655 . . . . 648.32 110.64 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.03 -41.81 97.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.017 -0.538 . . . . 555.82 110.925 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -62.56 -43.14 99.55 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.616 -0.265 . . . . 912.86 110.873 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.41 -47.46 81.89 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.164 -0.471 . . . . 999.99 111.136 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.41 -45.75 97.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.186 -0.461 . . . . 322.08 111.076 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.203 -0.453 . . . . 443.19 111.449 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.46 97.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.375 -0.375 . . . . 427.97 111.716 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.16 -40.99 77.84 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.909 0.385 . . . . 552.67 111.247 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.72 -8.89 78.19 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 121.155 -0.545 . . . . 282.78 112.733 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -75.2 145.1 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.74 0.305 . . . . 999.99 111.354 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 34.8 p -83.88 120.54 75.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.441 -0.345 . . . . 423.41 110.67 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.98 146.52 37.32 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.498 2.132 . . . . 262.13 112.987 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 m -102.57 169.84 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 322.52 111.158 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.64 -40.48 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.204 -0.453 . . . . 195.73 111.205 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.43 -39.07 94.39 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.152 -0.547 . . . . 116.64 112.94 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.77 -40.53 95.48 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.826 0.346 . . . . 397.23 110.527 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -67.92 -40.09 83.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.085 -0.507 . . . . 273.3 111.563 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.3 p -68.26 -34.69 76.65 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.004 -0.278 . . . . 391.43 111.075 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -62.77 -45.2 93.79 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.958 0.408 . . . . 999.99 109.985 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.16 -41.33 97.19 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.702 -0.681 . . . . 292.18 110.785 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.95 -40.27 99.08 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.992 -0.549 . . . . 65.97 112.432 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.46 92.78 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.671 0.272 . . . . 184.99 111.247 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.01 -39.95 90.7 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.099 0.476 . . . . 381.14 110.734 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.76 -40.05 86.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.545 -0.752 . . . . 354.06 110.943 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.76 -14.14 57.66 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.875 -0.602 . . . . 88.8 114.162 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -78.25 -22.35 48.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.178 0.489 . . . . 999.99 111.441 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -109.01 115.43 30.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.899 0.381 . . . . 999.99 110.842 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.0 pt -131.85 153.04 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 120.876 0.37 . . . . 458.46 111.225 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.8 p-10 -116.24 20.73 14.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 388.05 110.703 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.96 -39.36 91.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.556 . . . . 538.07 111.627 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.26 96.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.895 0.379 . . . . 282.7 110.634 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -69.08 -40.14 78.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.738 -0.665 . . . . 999.99 110.53 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.71 -49.08 79.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.005 -0.543 . . . . 504.74 110.73 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -60.52 -48.3 82.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.067 -0.515 . . . . 999.99 110.869 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.21 -45.91 91.24 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.139 -0.482 . . . . 558.87 111.501 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.9 -40.79 98.63 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.551 -0.295 . . . . 412.73 111.695 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 110' ' ' MET . 61.1 tp -61.35 -47.39 86.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.294 -0.412 . . . . 665.66 110.573 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -66.71 -39.03 87.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.197 -0.456 . . . . 999.99 111.017 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.05 -40.63 81.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.92 -0.582 . . . . 746.24 111.953 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -82.52 -11.38 58.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.626 -0.261 . . . . 999.99 111.466 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.8 t30 55.01 44.28 28.46 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.189 0.518 . . . . 848.93 111.699 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' MET . . . . . 0.42 ' O ' HD13 ' A' ' 105' ' ' LEU . 26.5 mmt -117.45 128.74 55.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 999.99 110.534 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.415 HG23 HD13 ' A' ' 111' ' ' ILE . 50.6 mm -94.63 116.6 66.56 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.534 -0.303 . . . . 586.78 110.67 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.53 154.86 50.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.467 2.112 . . . . 310.73 112.312 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -81.7 121.43 26.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.774 0.321 . . . . 866.09 110.231 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -69.26 138.38 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.041 -0.527 . . . . 999.99 110.846 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 83.4 mt -99.24 112.72 63.82 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 579.24 112.011 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -60.45 -27.58 85.13 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.119 2.546 . . . . 684.25 111.996 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -60.57 -26.43 66.93 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.119 -0.946 . . . . 662.15 111.556 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' MET . . . . . 0.419 ' HE2' ' O ' ' A' ' 48' ' ' LYS . 30.8 mmm -57.18 -28.24 62.62 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.443 0.534 . . . . 999.99 112.443 -179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -60.2 -44.24 95.27 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.024 -0.361 . . . . 675.31 110.024 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -67.43 -39.19 85.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.064 -0.516 . . . . 900.95 110.821 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.409 HD12 HG23 ' A' ' 121' ' ' ILE . 34.9 mm -61.51 -45.05 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.164 -0.471 . . . . 500.83 110.865 179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -61.13 -40.11 92.54 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.97 -0.559 . . . . 834.99 111.288 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -67.37 -33.27 74.87 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.202 0.445 . . . . 999.99 112.202 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.4 mtp -76.76 129.74 36.72 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.301 0.482 . . . . 599.62 112.301 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -54.04 147.82 23.84 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 115.537 -0.756 . . . . 999.99 111.441 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.1 -28.2 86.51 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.758 2.306 . . . . 214.74 112.522 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.48 -31.32 72.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.168 -0.469 . . . . 248.66 111.291 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.21 -0.06 57.62 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.073 -0.512 . . . . 360.37 111.696 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.2 t -90.53 115.38 64.03 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.656 0.265 . . . . 334.76 110.636 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.9 159.46 48.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.786 2.324 . . . . 351.83 112.773 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -116.59 136.81 52.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 410.42 109.539 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -113.27 120.83 42.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.926 0.394 . . . . 999.99 111.358 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -84.17 163.37 19.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.825 -0.625 . . . . 551.94 110.23 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.2 mmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.282 -0.866 . . . . 965.93 110.685 -179.502 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.531 0.205 . . . . 999.99 110.771 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.1 t -150.01 119.03 6.69 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.253 -0.179 . . . . 999.99 110.554 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 44.6 m0 56.05 34.65 24.16 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.503 0.502 . . . . 999.99 112.219 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.4 m170 -99.15 5.07 46.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.724 0.297 . . . . 999.99 111.411 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.67 -90.35 0.52 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.436 -0.347 . . . . 999.99 110.782 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.6 t -124.75 126.95 72.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.525 -0.307 . . . . 521.04 110.7 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -82.27 124.95 77.88 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 999.99 110.363 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.06 141.16 43.3 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.439 2.093 . . . . 546.56 112.835 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -132.04 148.6 52.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.002 -0.545 . . . . 999.99 110.467 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 56.33 43.14 26.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.607 0.567 . . . . 999.99 112.052 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.52 137.02 49.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.268 -0.424 . . . . 999.99 111.251 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -88.04 104.31 16.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.404 . . . . 280.85 110.316 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -63.33 -39.16 93.77 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.775 -0.648 . . . . 999.99 112.166 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -41.31 90.72 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.738 0.304 . . . . 200.79 111.741 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -67.71 -33.91 75.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 518.33 109.932 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 96.5 mt-10 -64.98 -40.45 94.99 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.737 -0.665 . . . . 524.44 110.27 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.58 -46.44 96.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 115.955 -0.566 . . . . 407.88 111.037 179.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.45 92.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.927 -0.579 . . . . 136.03 110.322 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.2 tp -64.11 -39.27 93.67 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.409 -0.814 . . . . 505.3 110.898 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.561 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 98.4 mttt -59.22 -37.08 76.63 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.907 -0.588 . . . . 703.51 111.671 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.51 -43.76 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 324.41 110.461 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -68.56 -39.69 80.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.892 0.377 . . . . 685.46 110.554 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.78 -47.4 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.689 -0.687 . . . . 238.49 112.84 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.0 pt -63.33 -37.39 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 N-CA-C 112.577 0.584 . . . . 509.15 112.577 -178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.81 91.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.637 0.256 . . . . 183.06 111.441 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.43 -41.91 65.89 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.023 -0.608 . . . . 63.82 113.2 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -73.01 -19.02 61.28 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.731 0.641 . . . . 351.91 112.731 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -75.01 -36.49 61.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.072 -0.251 . . . . 145.09 111.045 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -63.65 -40.53 97.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.929 0.395 . . . . 999.99 110.191 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.65 -39.36 97.46 Favored Glycine 0 C--N 1.333 0.384 0 CA-C-N 115.701 -0.681 . . . . 82.9 112.177 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.414 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 83.7 mt -62.63 -40.67 97.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.717 0.294 . . . . 392.81 110.608 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.7 t -61.38 -42.79 95.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.789 -0.641 . . . . 455.7 111.36 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 68.5 mttm -61.38 -41.51 97.23 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.532 -0.304 . . . . 756.66 111.418 -179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -70.62 -43.9 68.34 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.287 0.565 . . . . 999.99 110.211 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 97.2 mt -63.27 -38.97 93.23 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.341 -0.845 . . . . 373.99 113.163 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -63.9 -18.65 64.42 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.508 0.558 . . . . 811.35 112.508 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -84.92 -44.99 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 112.031 0.382 . . . . 461.27 112.031 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -103.28 9.57 38.01 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.773 0.321 . . . . 575.93 111.775 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.99 -21.29 63.45 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.559 0.584 . . . . 226.53 114.559 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.49 -41.19 96.89 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 117.187 0.494 . . . . 999.99 111.696 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.7 p -113.69 10.23 17.92 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.911 0.337 . . . . 432.8 111.911 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.8 tp -71.64 124.58 25.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.126 0.417 . . . . 844.62 112.126 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.2 m -78.98 158.67 27.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 316.62 110.305 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -60.91 -44.78 96.68 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.664 0.269 . . . . 291.13 111.575 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.08 -31.76 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 N-CA-C 112.075 0.398 . . . . 467.63 112.075 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -64.9 -40.15 94.64 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.536 0.208 . . . . 430.34 110.82 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.439 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 29.3 ttpp -61.37 -45.86 92.61 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.26 -0.427 . . . . 667.57 110.43 179.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -65.22 -39.66 93.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.045 -0.525 . . . . 527.8 110.674 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.74 92.65 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.877 -0.602 . . . . 169.13 111.295 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.401 ' HA ' HD22 ' A' ' 50' ' ' LEU . 86.5 mt -63.42 -38.58 91.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.095 -0.502 . . . . 409.47 111.785 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.439 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 23.3 m-85 -61.66 -38.96 89.69 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.505 -0.554 . . . . 686.82 109.505 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -65.29 -41.75 93.82 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.674 -0.694 . . . . 213.85 109.74 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.6 t -62.43 -40.4 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.041 -0.527 . . . . 289.44 110.339 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -58.86 -39.42 81.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.561 -0.745 . . . . 358.19 110.963 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.7 mmm-85 -61.77 -42.23 98.72 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.722 -0.217 . . . . 999.99 110.583 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.35 -40.8 96.58 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.06 0.457 . . . . 999.99 110.116 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -61.65 -48.18 82.04 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.608 -0.724 . . . . 212.58 110.93 178.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -60.52 -46.84 88.67 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.828 -0.624 . . . . 262.65 112.023 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -65.65 -33.54 76.12 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 120.733 -0.387 . . . . 684.75 111.145 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.0 m -66.1 -45.99 79.22 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.194 0.521 . . . . 450.86 110.214 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -64.29 -45.29 88.67 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.635 -0.711 . . . . 587.54 110.445 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -62.73 -43.53 98.56 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.666 -0.697 . . . . 785.5 111.845 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.99 78.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.125 0.417 . . . . 290.18 112.125 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -60.07 -49.75 76.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 676.15 110.889 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.422 ' O ' HG12 ' A' ' 69' ' ' ILE . 54.4 m-85 -72.17 -37.76 69.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.328 -0.396 . . . . 824.3 111.658 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -53.0 -46.21 68.22 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.433 0.458 . . . . 839.61 110.788 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.44 -44.44 96.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.989 -0.551 . . . . 667.86 111.276 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -66.91 -40.69 87.76 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.582 0.586 . . . . 999.99 112.582 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.422 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.3 pt -79.21 -25.51 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 N-CA-C 112.203 0.446 . . . . 648.32 112.203 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.52 -41.89 95.32 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.529 0.204 . . . . 555.82 110.813 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.6 -47.15 86.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.335 -0.393 . . . . 912.86 110.618 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -63.38 -46.75 85.02 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.928 -0.578 . . . . 999.99 111.286 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.15 -44.99 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.146 -0.479 . . . . 322.08 111.162 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -61.24 -43.85 98.21 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.314 -0.403 . . . . 443.19 111.269 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.02 -40.35 97.47 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.517 -0.311 . . . . 427.97 111.402 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.13 -39.57 82.69 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.295 -0.411 . . . . 552.67 111.253 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.65 -0.04 89.22 Favored Glycine 0 C--N 1.332 0.317 0 CA-C-N 116.0 -0.546 . . . . 282.78 112.508 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.2 mmp_? -75.16 149.7 38.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.907 0.384 . . . . 999.99 111.227 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.4 p -106.83 101.07 35.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 423.41 110.807 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -59.88 142.52 98.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.132 2.555 . . . . 262.13 112.931 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.429 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 15.7 m -100.26 -176.36 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.988 -0.551 . . . . 322.52 110.971 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.7 t -59.64 -43.46 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.39 -0.368 . . . . 195.73 111.082 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.11 -39.55 95.96 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.894 -0.669 . . . . 116.64 112.52 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -62.16 -41.28 98.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.896 0.379 . . . . 397.23 110.72 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 47.6 m-85 -68.38 -39.95 81.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.968 -0.56 . . . . 273.3 111.416 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.4 p -67.34 -36.0 80.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 111.633 0.234 . . . . 391.43 111.633 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.61 -47.16 84.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.215 0.531 . . . . 999.99 110.095 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 tp -67.99 -42.09 81.29 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.575 -0.739 . . . . 292.18 110.514 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.32 -39.39 97.16 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.763 -0.653 . . . . 65.97 113.042 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -60.77 -40.76 93.73 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.756 0.312 . . . . 184.99 110.869 179.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.4 -39.44 93.86 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.097 -0.501 . . . . 381.14 110.352 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.4 mm -63.9 -42.09 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.628 -0.715 . . . . 354.06 110.758 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -71.17 -9.35 67.11 Favored Glycine 0 CA--C 1.521 0.466 0 CA-C-N 115.842 -0.617 . . . . 88.8 113.995 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.3 mmm180 -77.72 -25.96 49.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.314 0.557 . . . . 999.99 111.331 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -108.53 112.15 24.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.891 0.376 . . . . 999.99 110.681 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 79.0 mt -125.68 125.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 458.46 110.591 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -137.44 65.67 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.883 0.373 . . . . 388.05 110.581 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.3 ptm -72.38 -21.12 61.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.987 -0.552 . . . . 538.07 110.755 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.27 89.82 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.886 -0.597 . . . . 282.7 110.681 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.22 -48.35 82.1 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.796 -0.638 . . . . 999.99 111.143 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -62.81 -44.06 97.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.354 -0.384 . . . . 504.74 110.301 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -60.67 -47.67 85.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.911 -0.586 . . . . 999.99 110.539 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.46 -41.68 97.59 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.762 -0.654 . . . . 558.87 111.062 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.07 98.08 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.387 -0.37 . . . . 412.73 111.209 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.95 -41.09 97.69 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.46 -0.336 . . . . 665.66 110.598 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -63.0 -44.53 95.77 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.807 -0.633 . . . . 999.99 111.158 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.78 -39.79 82.11 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.075 -0.512 . . . . 746.24 112.155 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -91.37 0.19 57.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.562 -0.29 . . . . 999.99 111.697 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 57.5 36.2 26.68 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.022 0.439 . . . . 848.93 111.21 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 16.7 mmt -100.19 79.39 2.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.167 0.508 . . . . 999.99 111.088 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 71.6 mt -93.65 120.67 65.96 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.896 -0.593 . . . . 586.78 110.17 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.91 149.93 66.63 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.366 2.044 . . . . 310.73 112.504 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -80.11 129.67 34.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 866.09 110.63 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -69.87 86.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.97 -0.559 . . . . 999.99 111.199 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.97 149.67 35.96 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 579.24 111.297 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.18 -25.22 65.27 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.737 2.292 . . . . 684.25 112.322 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -60.63 -45.14 95.17 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.04 -0.527 . . . . 662.15 111.338 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 96.8 mtp -59.99 -40.68 90.01 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.249 -0.432 . . . . 999.99 109.885 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.28 -40.43 96.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.777 -0.647 . . . . 675.31 110.374 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -62.97 -42.13 99.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.859 -0.61 . . . . 900.95 111.179 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.29 -44.49 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.68 0.276 . . . . 500.83 110.449 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -61.25 -41.81 97.55 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.059 -0.518 . . . . 834.99 111.346 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -65.63 -33.88 76.93 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.346 -0.388 . . . . 999.99 111.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.8 mtp -72.57 140.68 48.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 599.62 111.714 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.41 ' O ' HG21 ' A' ' 129' ' ' VAL . 91.3 mtm180 -52.38 141.3 33.13 Favored Pre-proline 0 C--O 1.234 0.281 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.237 178.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -60.78 -25.73 81.67 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.677 2.251 . . . . 214.74 112.548 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.16 80.57 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.029 -0.532 . . . . 248.66 111.618 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.65 -2.54 57.85 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.339 -0.391 . . . . 360.37 111.934 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.41 HG21 ' O ' ' A' ' 125' ' ' ARG . 60.9 t -93.18 116.1 65.99 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.243 -0.28 . . . . 334.76 110.243 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.21 151.03 72.22 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.44 2.094 . . . . 351.83 112.752 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.1 t -109.06 137.43 41.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.913 -0.585 . . . . 410.42 110.134 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.1 141.93 47.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.829 0.347 . . . . 999.99 110.733 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -83.39 158.83 21.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 551.94 110.81 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.348 -0.834 . . . . 965.93 111.139 -179.12 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 . . . . . 0 N--CA 1.469 0.478 0 CA-C-O 121.374 0.607 . . . . 999.99 112.603 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.7 p -153.06 164.35 38.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.247 -0.888 . . . . 999.99 109.361 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.411 ' HB3' ' H ' ' A' ' 4' ' ' HIS . 7.5 t-105 -115.96 -89.88 0.56 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 120.418 -0.513 . . . . 999.99 111.643 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.411 ' H ' ' HB3' ' A' ' 3' ' ' TRP . 15.6 t60 -165.15 167.74 17.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.454 0.168 . . . . 999.99 110.968 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 70.35 -94.88 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.528 0 O-C-N 123.922 0.764 . . . . 999.99 111.967 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.7 t -115.46 120.64 65.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.919 0.39 . . . . 521.04 111.089 -179.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -91.52 119.98 68.38 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 999.99 110.562 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.44 139.38 34.48 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.295 1.996 . . . . 546.56 112.392 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -98.22 -11.33 22.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.963 0.411 . . . . 999.99 111.292 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -108.85 12.46 25.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.351 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.81 114.49 2.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.017 0.437 . . . . 999.99 111.602 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -114.91 126.77 55.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 280.85 110.037 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.54 -39.49 91.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.769 0.319 . . . . 999.99 110.841 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.77 87.87 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.242 -0.435 . . . . 200.79 111.412 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -68.23 -32.48 72.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.009 -0.541 . . . . 518.33 110.108 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -63.08 -41.61 99.46 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.738 -0.665 . . . . 524.44 109.961 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.12 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 115.803 -0.635 . . . . 407.88 111.033 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.16 -40.87 97.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.232 -0.44 . . . . 136.03 110.626 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.77 -43.01 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.823 -0.626 . . . . 505.3 110.312 178.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -59.72 -44.21 93.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.391 -0.822 . . . . 703.51 111.498 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.66 -42.82 97.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 324.41 111.69 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -63.9 -41.13 97.78 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.738 0.304 . . . . 685.46 111.177 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.263 -0.426 . . . . 238.49 110.582 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.59 -42.87 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 115.972 -0.558 . . . . 509.15 111.325 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.49 95.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.743 0.275 . . . . 183.06 111.743 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.98 -41.28 97.4 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 120.801 -0.714 . . . . 63.82 112.493 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.489 ' O ' HD11 ' A' ' 31' ' ' LEU . 10.6 m-30 -73.18 -19.6 61.07 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.726 0.41 . . . . 351.91 111.504 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -75.64 -34.67 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.315 . . . . 145.09 111.046 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.75 -44.23 96.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.998 0.428 . . . . 999.99 109.907 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.04 -37.59 94.14 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.533 -0.758 . . . . 82.9 112.521 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.489 HD11 ' O ' ' A' ' 27' ' ' PHE . 6.7 mp -68.83 -41.27 78.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.71 0.291 . . . . 392.81 110.403 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.9 -44.9 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.018 -0.537 . . . . 455.7 110.779 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 -40.14 95.07 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.756 0.312 . . . . 756.66 110.944 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.6 t90 -64.96 -42.0 94.99 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.315 -0.624 . . . . 999.99 109.315 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.446 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 83.6 mt -62.67 -36.68 83.65 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.332 -0.849 . . . . 373.99 111.293 179.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.13 -37.72 86.23 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.585 0.217 . . . . 811.35 111.585 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.2 t -87.01 -50.59 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 113.616 0.969 . . . . 461.27 113.616 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -99.77 -1.49 37.54 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.083 0.771 . . . . 575.93 113.083 -177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.446 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -73.51 -11.87 80.19 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 121.233 -0.508 . . . . 226.53 114.05 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.54 -41.17 96.95 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.91 0.355 . . . . 999.99 111.533 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 61.7 p -113.29 5.44 16.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.875 0.369 . . . . 432.8 111.694 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.4 tp -71.85 133.38 45.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.054 -0.521 . . . . 844.62 111.3 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -75.89 161.52 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.039 -0.528 . . . . 316.62 111.266 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.1 -44.54 94.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.998 -0.547 . . . . 291.13 111.913 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.48 -30.4 47.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.558 0.218 . . . . 467.63 111.352 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -67.04 -38.12 85.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.47 -0.332 . . . . 430.34 110.344 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -62.7 -40.41 97.04 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.074 0.464 . . . . 667.57 110.242 178.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -69.48 -33.01 72.26 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.627 -0.715 . . . . 527.8 110.784 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.33 76.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.833 -0.621 . . . . 169.13 111.639 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 50' ' ' LEU . 82.0 mt -60.49 -39.18 86.74 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.832 0.308 . . . . 409.47 111.832 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -63.55 -39.04 93.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.916 -0.402 . . . . 686.82 109.916 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -70.11 -40.72 74.72 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.758 -0.655 . . . . 213.85 110.449 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.6 t -63.59 -40.49 89.25 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 N-CA-C 109.655 -0.498 . . . . 289.44 109.655 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -59.34 -39.82 84.41 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.455 -0.793 . . . . 358.19 110.52 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 ttt-85 -60.69 -47.63 85.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.49 -0.323 . . . . 999.99 110.625 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.67 -41.26 96.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.139 0.495 . . . . 999.99 110.552 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -61.89 -47.35 85.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.46 -0.791 . . . . 212.58 110.905 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.5 ttt -59.81 -48.21 82.62 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.429 -0.805 . . . . 262.65 112.82 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -66.04 -31.3 72.1 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.149 0.425 . . . . 684.75 112.149 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.6 m -64.0 -49.72 71.33 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.882 0.372 . . . . 450.86 110.962 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.502 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 76.1 m-70 -72.56 -36.91 68.34 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.235 -0.439 . . . . 587.54 111.636 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -60.13 -45.32 93.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.939 -0.573 . . . . 785.5 111.088 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.76 90.85 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.884 0.327 . . . . 290.18 111.884 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -64.44 -42.22 96.11 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.751 0.31 . . . . 676.15 111.175 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.502 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 38.5 m-85 -70.34 -37.48 74.66 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.245 -0.434 . . . . 824.3 111.371 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.0 ttp -52.29 -46.12 65.79 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.086 -0.506 . . . . 839.61 111.722 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.02 -41.49 98.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.462 -0.335 . . . . 667.86 111.056 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -67.72 -41.59 83.24 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.067 0.46 . . . . 999.99 110.666 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.46 -45.63 97.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 115.637 -0.71 . . . . 648.32 111.223 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -61.86 -40.88 96.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.312 -0.404 . . . . 555.82 111.571 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.77 -42.29 97.82 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.699 0.285 . . . . 912.86 110.747 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.46 -46.16 87.5 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.08 -0.509 . . . . 999.99 111.098 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.64 -46.5 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 CA-C-N 116.196 -0.456 . . . . 322.08 111.111 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.14 -45.3 92.6 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.379 -0.373 . . . . 443.19 111.667 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.56 97.47 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.114 0.413 . . . . 427.97 112.114 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -76.08 -44.36 39.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.865 0.364 . . . . 552.67 111.334 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.46 -10.82 73.27 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.207 -0.521 . . . . 282.78 113.132 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -75.34 155.27 36.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.951 0.405 . . . . 999.99 111.571 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.435 ' O ' HG23 ' A' ' 79' ' ' THR . 6.9 t -93.38 116.95 67.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-N 116.158 -0.473 . . . . 423.41 110.374 178.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.27 141.9 40.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.322 2.015 . . . . 262.13 113.178 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.451 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 17.9 m -102.45 -176.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 322.52 110.976 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 75.3 t -62.68 -41.03 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.904 0.383 . . . . 195.73 110.112 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.596 ' O ' HG21 ' A' ' 86' ' ' THR . . . -60.11 -38.73 94.81 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.795 -0.638 . . . . 116.64 112.39 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -62.02 -40.98 97.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.038 0.447 . . . . 397.23 110.31 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.451 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 48.5 m-85 -69.18 -38.18 78.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.809 -0.632 . . . . 273.3 111.451 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.596 HG21 ' O ' ' A' ' 83' ' ' GLY . 0.7 OUTLIER -64.47 -36.12 83.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 121.074 -0.25 . . . . 391.43 110.812 -179.736 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.77 -41.25 92.28 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.027 0.441 . . . . 999.99 110.292 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -66.3 -41.34 89.87 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.733 -0.667 . . . . 292.18 110.388 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.24 -40.07 98.62 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 115.645 -0.707 . . . . 65.97 112.417 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.45 -40.56 94.92 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.484 0.183 . . . . 184.99 111.023 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.13 -40.89 97.15 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.031 0.443 . . . . 381.14 110.659 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.02 -41.5 92.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.75 -0.659 . . . . 354.06 110.658 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -69.29 -10.04 61.96 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.677 -0.692 . . . . 88.8 114.093 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 29.0 mmt85 -78.05 -22.25 49.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.404 0.602 . . . . 999.99 111.299 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -108.42 112.81 25.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.675 0.274 . . . . 999.99 110.314 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.9 mt -126.28 113.54 34.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.108 -0.33 . . . . 458.46 110.108 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -111.62 30.1 7.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.334 -0.394 . . . . 388.05 112.014 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -61.53 -41.33 97.18 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 111.666 0.247 . . . . 538.07 111.666 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.36 94.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.168 0.509 . . . . 282.7 110.989 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -65.31 -35.76 81.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.543 -0.753 . . . . 999.99 111.764 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.418 ' O ' HD12 ' A' ' 105' ' ' LEU . 78.9 t80 -58.52 -49.37 77.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.666 0.27 . . . . 504.74 110.987 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -66.09 -38.2 87.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.499 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.37 -41.12 96.57 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.743 0.306 . . . . 558.87 110.349 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.07 -41.32 97.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.114 -0.494 . . . . 412.73 111.132 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.418 HD12 ' O ' ' A' ' 101' ' ' PHE . 7.3 mp -67.97 -40.9 83.09 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.009 -0.541 . . . . 665.66 111.236 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.18 -39.39 94.52 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.485 -0.325 . . . . 999.99 110.791 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.18 -41.45 83.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.095 -0.502 . . . . 746.24 111.322 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -91.46 1.41 57.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.468 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 58.66 42.21 20.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.058 -0.519 . . . . 848.93 111.512 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 97.7 mmm -102.57 101.82 12.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 999.99 110.795 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.4 mm -94.13 119.81 66.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 586.78 110.794 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.45 153.26 55.34 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.606 2.204 . . . . 310.73 112.434 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -83.91 127.37 33.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.443 -0.344 . . . . 866.09 110.508 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -69.68 122.73 19.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.122 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.9 mt -99.69 117.12 64.17 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 579.24 111.589 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.14 -24.0 38.94 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.423 2.082 . . . . 684.25 112.093 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -65.48 -25.25 67.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.553 -0.749 . . . . 662.15 111.275 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -32.36 49.96 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.018 -0.537 . . . . 999.99 111.953 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.48 -40.12 90.14 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.821 0.343 . . . . 675.31 110.799 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.75 -38.48 89.21 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.94 -0.573 . . . . 900.95 110.872 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.402 HD12 HG22 ' A' ' 121' ' ' ILE . 34.6 mm -61.17 -44.95 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.126 -0.488 . . . . 500.83 110.9 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -60.87 -38.4 85.48 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.415 -0.357 . . . . 834.99 111.304 179.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -65.48 -33.07 75.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.154 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 89.7 mmm -70.02 133.58 47.37 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.998 -0.547 . . . . 599.62 111.605 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.462 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.9 mmp_? -53.34 138.41 48.71 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.972 -0.558 . . . . 999.99 111.163 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.84 -38.99 85.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.91 2.406 . . . . 214.74 113.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -65.28 -26.54 68.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.39 -0.368 . . . . 248.66 111.711 179.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -91.68 -3.47 56.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.433 -0.349 . . . . 360.37 111.799 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 125' ' ' ARG . 59.7 t -91.99 114.99 63.8 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.662 0.268 . . . . 334.76 110.543 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.24 147.89 60.77 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.279 1.986 . . . . 351.83 112.344 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.8 m -128.89 153.03 37.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.133 -0.485 . . . . 410.42 110.323 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -128.39 137.28 51.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 999.99 110.979 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -85.21 175.65 8.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.996 -0.547 . . . . 551.94 109.907 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.3 -0.857 . . . . 965.93 110.871 -179.228 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 . . . . . 0 N--CA 1.472 0.667 0 CA-C-O 120.883 0.373 . . . . 999.99 111.634 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.2 p -115.44 4.02 14.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.479 -0.328 . . . . 999.99 111.209 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 3.3 m95 60.92 22.53 12.68 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.018 -0.537 . . . . 999.99 111.862 -179.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.431 ' HB3' ' H ' ' A' ' 5' ' ' TYR . 67.6 m80 58.07 -160.65 0.25 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.946 0.498 . . . . 999.99 111.585 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.431 ' H ' ' HB3' ' A' ' 4' ' ' HIS . 97.4 m-85 -110.48 7.16 22.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.598 0.237 . . . . 999.99 111.399 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -119.09 120.88 65.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.821 0.343 . . . . 521.04 111.032 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -87.78 154.62 53.1 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 999.99 110.758 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.05 152.41 72.96 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.544 2.163 . . . . 546.56 112.298 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -82.12 55.61 2.88 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.168 0.433 . . . . 999.99 112.168 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 49.53 64.31 1.81 Allowed 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.43 0.456 . . . . 999.99 111.939 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -55.51 132.38 48.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.08 0.467 . . . . 999.99 111.482 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -73.19 132.53 43.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.688 -0.687 . . . . 280.85 111.372 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.07 -41.94 97.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.058 -0.519 . . . . 999.99 111.044 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.564 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.53 -39.16 83.02 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.976 0.417 . . . . 200.79 111.375 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.429 ' CD1' ' HB ' ' A' ' 82' ' ' VAL . 11.9 m-30 -68.45 -34.02 75.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.133 -0.485 . . . . 518.33 109.968 179.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.39 -40.6 93.66 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.615 -0.721 . . . . 524.44 111.761 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.564 HG12 ' O ' ' A' ' 14' ' ' ALA . 9.8 p -69.79 -36.57 70.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 120.777 -0.369 . . . . 407.88 111.378 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.439 ' O ' HG13 ' A' ' 21' ' ' VAL . . . -63.78 -42.05 97.82 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 121.102 0.477 . . . . 136.03 110.477 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.89 -40.86 78.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.603 -0.726 . . . . 505.3 111.01 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.459 ' O ' HG12 ' A' ' 24' ' ' ILE . 40.2 ttpt -59.63 -45.17 92.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.726 -0.67 . . . . 703.51 112.559 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 18' ' ' ALA . 8.5 p -64.81 -33.14 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 120.861 -0.336 . . . . 324.41 111.346 -178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.94 -41.52 86.83 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.14 0.495 . . . . 685.46 110.22 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.05 -42.49 88.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.431 -0.804 . . . . 238.49 110.427 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 mm -60.57 -44.12 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 115.754 -0.657 . . . . 509.15 111.268 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.34 97.34 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.53 0.205 . . . . 183.06 111.353 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.37 -41.4 96.54 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 121.005 -0.617 . . . . 63.82 112.675 179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -71.92 -25.55 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.754 0.311 . . . . 351.91 111.335 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.48 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.1 t0 -76.91 -36.25 56.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 145.09 110.874 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -60.38 -46.59 89.43 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.845 -0.428 . . . . 999.99 109.845 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.97 -39.27 96.34 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.776 -0.647 . . . . 82.9 112.038 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 60.8 tp -61.64 -40.48 95.06 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 122.659 0.384 . . . . 392.81 111.379 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 28' ' ' ASP . 58.8 t -59.51 -44.26 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.762 -0.199 . . . . 455.7 110.946 -179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.4 -40.78 97.61 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.973 0.416 . . . . 756.66 110.528 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 72.8 t90 -65.86 -41.66 91.36 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.913 -0.585 . . . . 999.99 109.961 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.42 ' HA ' ' HA3' ' A' ' 39' ' ' GLY . 87.8 mt -61.25 -36.84 81.08 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.64 -0.709 . . . . 373.99 111.468 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.72 -37.77 85.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.551 -0.295 . . . . 811.35 111.296 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.88 -51.16 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 113.53 0.937 . . . . 461.27 113.53 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -109.95 -22.8 11.67 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.174 0.805 . . . . 575.93 113.174 -177.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 35' ' ' LEU . . . -62.38 -21.39 62.18 Favored Glycine 0 N--CA 1.461 0.335 0 C-N-CA 121.145 -0.55 . . . . 226.53 113.828 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -62.84 -18.18 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.079 0.4 . . . . 999.99 112.079 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.0 p -102.81 -6.14 22.88 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.484 0.549 . . . . 432.8 112.484 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.42 142.77 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.035 0.445 . . . . 844.62 111.719 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.3 m -77.6 161.45 27.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.725 -0.67 . . . . 316.62 110.67 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -41.27 93.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.373 -0.376 . . . . 291.13 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.467 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 58.3 t -65.55 -42.74 93.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.157 -0.474 . . . . 467.63 110.721 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.657 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 96.5 mt-30 -63.07 -41.14 99.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.007 -0.542 . . . . 430.34 111.219 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -61.51 -46.69 88.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.262 -0.426 . . . . 667.57 111.353 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.73 -40.17 91.89 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.85 0.357 . . . . 527.8 111.383 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.27 -25.27 68.24 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.046 -0.525 . . . . 169.13 112.214 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 94.0 mt -64.08 -24.37 67.67 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.01 0.744 . . . . 409.47 113.01 -178.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -60.57 -40.71 92.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 686.82 110.338 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -70.65 -37.17 73.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.24 -0.436 . . . . 213.85 110.409 178.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.63 -42.89 97.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.685 -0.689 . . . . 289.44 110.529 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -60.66 -40.13 90.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.94 -0.573 . . . . 358.19 111.173 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -60.87 -46.52 90.29 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.747 0.308 . . . . 999.99 110.414 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.42 -38.74 92.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 999.99 110.706 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.93 -49.01 79.37 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.634 -0.712 . . . . 212.58 111.685 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ptm -67.63 -37.16 82.07 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 121.065 -0.254 . . . . 262.65 111.483 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -65.61 -38.0 88.21 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 111.849 0.314 . . . . 684.75 111.849 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -60.15 -48.17 82.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.72 0.295 . . . . 450.86 111.006 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -71.34 -40.44 70.69 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.794 0.33 . . . . 587.54 111.22 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.9 t-105 -62.6 -45.7 91.68 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.418 0.525 . . . . 785.5 112.418 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.25 84.28 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 112.383 0.512 . . . . 290.18 112.383 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -62.02 -48.7 79.1 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.868 0.366 . . . . 676.15 111.155 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -72.15 -37.39 69.42 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.171 -0.468 . . . . 824.3 112.193 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 67.2 ttp -52.73 -46.79 67.57 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.396 -0.365 . . . . 839.61 111.94 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -63.06 -44.14 96.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.82 -0.173 . . . . 667.86 111.15 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -63.35 -47.09 83.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.983 0.42 . . . . 999.99 110.628 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.34 -42.91 98.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 115.694 -0.685 . . . . 648.32 110.979 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -59.98 -42.06 93.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.232 -0.44 . . . . 555.82 111.428 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.59 -41.39 98.92 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.938 -0.305 . . . . 912.86 110.532 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.97 -45.45 92.38 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.043 -0.526 . . . . 999.99 110.254 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.45 -44.56 99.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.667 -0.697 . . . . 322.08 110.706 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -61.1 -44.57 97.16 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.111 -0.495 . . . . 443.19 111.138 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.4 97.25 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.426 -0.352 . . . . 427.97 111.409 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.73 -39.65 80.27 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.293 -0.412 . . . . 552.67 111.291 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.43 77.46 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.178 -0.534 . . . . 282.78 112.278 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.95 152.61 38.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 999.99 111.442 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.5 p -117.95 94.48 46.43 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.371 -0.377 . . . . 423.41 110.476 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -72.12 150.27 53.62 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.762 2.308 . . . . 262.13 113.331 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.6 m -101.47 173.08 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.703 -0.68 . . . . 322.52 110.536 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.429 ' HB ' ' CD1' ' A' ' 15' ' ' PHE . 9.0 p -56.33 -26.75 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.631 -0.258 . . . . 195.73 111.643 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.26 -38.66 96.04 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 121.11 -0.567 . . . . 116.64 112.012 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -73.62 -29.07 62.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.037 0.446 . . . . 397.23 110.698 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -69.16 -24.82 64.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.637 -0.71 . . . . 273.3 112.217 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 70.2 p -59.29 -35.83 74.48 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.553 0.216 . . . . 391.43 111.127 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -62.66 -44.9 95.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.034 0.445 . . . . 999.99 110.052 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -65.44 -41.04 93.9 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.705 -0.679 . . . . 292.18 110.492 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.17 98.83 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.598 -0.728 . . . . 65.97 112.652 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.29 -40.14 93.03 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.766 0.317 . . . . 184.99 111.098 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -65.22 -41.19 94.66 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.173 -0.467 . . . . 381.14 110.205 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.52 -42.77 96.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 354.06 110.691 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.62 -36.89 92.51 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.785 -0.643 . . . . 88.8 113.445 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -79.67 -10.87 59.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.196 0.443 . . . . 999.99 112.196 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -108.37 112.47 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 999.99 111.03 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.1 pt -131.85 152.09 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.488 -0.324 . . . . 458.46 111.154 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -155.2 38.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.2 0.524 . . . . 388.05 109.791 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.452 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 24.7 ptp -74.77 -16.19 60.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.665 -0.698 . . . . 538.07 112.356 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.15 96.62 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.763 0.316 . . . . 282.7 111.356 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -71.15 -35.19 71.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.355 -0.384 . . . . 999.99 110.971 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.74 -46.68 89.5 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.09 -0.504 . . . . 504.74 110.624 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 98' ' ' MET . 45.1 m-85 -63.45 -40.94 98.47 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.623 -0.262 . . . . 999.99 110.975 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -63.52 -40.76 97.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.21 -0.45 . . . . 558.87 110.668 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.32 -41.32 98.91 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.945 -0.57 . . . . 412.73 111.25 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -42.7 99.29 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.253 -0.431 . . . . 665.66 110.786 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -64.0 -42.33 97.21 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.082 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.7 -42.65 84.14 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 746.24 111.791 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -89.41 -3.24 58.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.347 . . . . 999.99 111.396 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.89 42.95 28.27 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.58 0.55 . . . . 848.93 111.447 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mtp -99.74 84.2 2.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.211 -0.449 . . . . 999.99 111.22 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.2 mt -94.43 117.05 67.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 586.78 110.303 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.99 139.96 90.38 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.813 2.342 . . . . 310.73 112.718 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.61 144.88 28.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 866.09 110.66 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.467 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 65.1 t80 -68.55 108.78 3.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.833 0.349 . . . . 999.99 111.155 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.43 138.57 20.51 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.087 -0.506 . . . . 579.24 110.851 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.03 -33.6 96.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.836 2.357 . . . . 684.25 112.042 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -61.06 -38.78 87.42 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.393 -0.821 . . . . 662.15 111.472 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 64.4 mtt -60.18 -41.78 93.6 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.785 0.326 . . . . 999.99 110.532 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -61.88 -42.55 99.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 675.31 110.622 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.12 -41.08 99.27 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.275 -0.421 . . . . 900.95 110.935 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.94 -44.32 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.142 -0.481 . . . . 500.83 110.796 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -38.33 90.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.349 -0.387 . . . . 834.99 111.704 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.44 -35.11 79.94 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.655 0.613 . . . . 999.99 112.655 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.5 ptp -90.51 149.38 22.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.035 0.445 . . . . 599.62 112.175 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.7 mmp_? -53.51 145.61 27.74 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 115.458 -0.792 . . . . 999.99 111.211 178.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.79 -26.21 81.57 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.948 2.432 . . . . 214.74 112.87 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.401 ' HA ' ' CG2' ' A' ' 17' ' ' VAL . . . -62.35 -35.98 80.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 248.66 111.695 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.73 -1.08 57.88 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.45 -0.341 . . . . 360.37 111.785 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 94.0 t -81.87 121.99 79.71 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 334.76 110.758 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -68.56 149.1 73.86 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.39 2.06 . . . . 351.83 112.534 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.71 137.95 55.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.9 -0.591 . . . . 410.42 110.052 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -122.35 136.71 54.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 999.99 110.875 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.12 171.3 12.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 551.94 110.45 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.185 -0.912 . . . . 965.93 111.115 -179.274 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 120.783 0.325 . . . . 999.99 110.445 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.8 m -124.25 139.1 54.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 999.99 111.249 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -118.75 147.16 44.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 999.99 110.157 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -85.56 -171.6 3.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.489 . . . . 999.99 111.067 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -67.79 -24.68 65.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.119 -0.491 . . . . 999.99 111.156 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.5 t -99.93 126.6 53.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 521.04 109.904 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 pm0 -79.16 156.74 76.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 999.99 110.959 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -68.37 152.14 75.65 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.425 2.083 . . . . 546.56 112.573 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -109.59 151.24 27.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.399 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -82.14 73.5 9.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 999.99 111.087 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.96 151.38 14.89 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.608 -0.724 . . . . 999.99 111.351 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -61.57 129.05 39.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.354 -0.385 . . . . 280.85 110.582 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.74 -39.94 93.33 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.07 -0.514 . . . . 999.99 111.655 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.03 87.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.013 0.435 . . . . 200.79 111.422 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -70.52 -34.72 72.62 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 518.33 110.222 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -67.01 -41.14 87.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.699 -0.682 . . . . 524.44 112.07 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.425 ' CG1' ' HA ' ' A' ' 127' ' ' ALA . 30.1 m -73.8 -28.99 25.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 N-CA-C 112.033 0.383 . . . . 407.88 112.033 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.73 93.29 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.222 0.534 . . . . 136.03 109.892 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.11 -36.06 72.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.279 -0.873 . . . . 505.3 111.081 178.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.459 ' O ' HG12 ' A' ' 24' ' ' ILE . 64.4 tttm -59.11 -41.93 89.34 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.641 -0.709 . . . . 703.51 111.712 -178.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.88 -44.6 99.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.584 0.23 . . . . 324.41 110.99 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -64.71 -43.26 94.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.944 0.402 . . . . 685.46 110.955 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.4 -43.92 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 115.795 -0.639 . . . . 238.49 111.59 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 20' ' ' LYS . 29.9 mm -61.06 -41.23 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 116.373 -0.376 . . . . 509.15 111.451 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.03 95.05 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.524 0.194 . . . . 183.06 111.524 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.48 -41.37 98.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.831 -0.699 . . . . 63.82 112.548 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -74.48 -20.1 60.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.633 0.254 . . . . 351.91 111.531 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -76.13 -37.27 58.23 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.969 -0.382 . . . . 145.09 109.969 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -63.3 -40.69 98.06 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.103 -0.703 . . . . 999.99 109.103 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.511 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.81 -37.23 93.96 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.013 -0.994 . . . . 82.9 112.58 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.502 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 82.0 mt -58.76 -36.53 74.52 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.164 0.186 . . . . 392.81 111.171 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.32 -41.61 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 116.214 -0.448 . . . . 455.7 111.222 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.52 -42.57 99.01 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.525 0.202 . . . . 756.66 111.381 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.511 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 8.0 m-90 -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.531 0.205 . . . . 999.99 110.992 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.3 mt -62.78 -37.21 85.75 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.93 0.395 . . . . 373.99 110.863 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.94 -37.29 86.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.322 -0.399 . . . . 811.35 111.384 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.66 -51.99 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 113.424 0.898 . . . . 461.27 113.424 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.429 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.93 -21.26 12.73 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.967 0.728 . . . . 575.93 112.967 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.73 -37.9 93.08 Favored Glycine 0 N--CA 1.46 0.25 0 C-N-CA 121.233 -0.508 . . . . 226.53 113.325 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -61.71 -20.46 63.52 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.988 0.366 . . . . 999.99 111.988 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.3 p -105.63 -4.36 21.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.983 0.364 . . . . 432.8 111.983 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 91.0 mt -72.92 146.28 46.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.084 0.469 . . . . 844.62 111.63 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.0 m -76.82 164.55 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.808 -0.633 . . . . 316.62 110.582 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.6 m -59.67 -41.95 91.78 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.346 -0.388 . . . . 291.13 111.072 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 69.5 t -65.87 -42.47 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.26 -0.427 . . . . 467.63 110.482 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -63.28 -40.59 97.81 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.125 -0.488 . . . . 430.34 111.16 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -61.38 -46.66 89.27 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.271 -0.422 . . . . 667.57 110.784 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.58 -39.71 91.94 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.303 -0.408 . . . . 527.8 111.177 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.27 83.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.722 -0.672 . . . . 169.13 111.907 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.6 -32.08 49.64 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.77 0.656 . . . . 409.47 112.77 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -62.93 -42.88 99.94 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.801 0.334 . . . . 686.82 110.751 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -70.99 -39.27 72.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.196 0.522 . . . . 213.85 109.813 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -60.5 -41.42 87.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.252 -0.885 . . . . 289.44 111.191 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.68 -45.19 89.97 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.501 0.191 . . . . 358.19 110.921 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -65.07 -41.59 94.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.747 0.308 . . . . 999.99 110.747 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -63.9 -40.84 97.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.266 0.555 . . . . 999.99 110.253 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -58.96 -48.51 81.27 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.282 -0.872 . . . . 212.58 110.376 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -45.7 92.03 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.729 -0.669 . . . . 262.65 111.49 179.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.54 -39.65 94.29 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.264 -0.425 . . . . 684.75 111.689 -179.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.5 m -61.09 -47.06 88.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.985 0.421 . . . . 450.86 110.776 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.493 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 67.7 m80 -70.12 -38.71 75.65 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.088 -0.505 . . . . 587.54 111.346 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -60.29 -48.16 82.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.301 -0.409 . . . . 785.5 111.02 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.64 94.19 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 111.843 0.312 . . . . 290.18 111.843 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.85 -48.45 78.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.426 -0.352 . . . . 676.15 111.727 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.493 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 62.7 m-85 -71.06 -36.38 72.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.524 -0.307 . . . . 824.3 111.79 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 62.4 ttp -52.42 -44.89 65.67 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.381 0.425 . . . . 839.61 112.062 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.8 mt -61.45 -42.23 98.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.479 0.18 . . . . 667.86 111.16 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -68.84 -40.39 79.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 999.99 110.593 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.411 ' O ' HG12 ' A' ' 73' ' ' ILE . 95.1 mt -63.65 -44.84 98.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.761 -0.654 . . . . 648.32 110.883 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.69 -39.43 88.46 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.282 -0.417 . . . . 555.82 111.567 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.28 -48.19 82.8 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.857 0.361 . . . . 912.86 110.496 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.7 tptm -64.79 -45.11 87.68 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.858 -0.61 . . . . 999.99 111.092 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 69' ' ' ILE . 37.4 mm -62.96 -45.8 97.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.028 -0.533 . . . . 322.08 111.948 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -61.6 -40.46 94.9 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.745 -0.207 . . . . 443.19 110.997 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.5 95.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.345 . . . . 427.97 111.135 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.9 mt -70.06 -39.94 75.36 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.189 -0.46 . . . . 552.67 111.425 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.9 -8.82 79.26 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 121.107 -0.568 . . . . 282.78 112.411 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -74.73 152.07 39.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.622 0.249 . . . . 999.99 111.318 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -115.2 94.36 38.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.51 -0.314 . . . . 423.41 110.987 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.34 143.23 97.78 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.323 2.682 . . . . 262.13 113.446 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.431 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 16.2 m -100.76 -177.82 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.842 -0.617 . . . . 322.52 110.607 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.1 t -58.13 -42.48 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-N 116.421 -0.354 . . . . 195.73 110.88 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.629 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -39.47 96.83 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.894 -0.669 . . . . 116.64 112.28 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.21 -38.52 91.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 397.23 111.428 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.431 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 39.3 m-85 -67.91 -26.4 65.97 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.749 0.648 . . . . 273.3 112.749 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.629 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -57.14 -34.66 68.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 121.004 -0.278 . . . . 391.43 111.218 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -65.53 -41.11 93.43 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.954 0.407 . . . . 999.99 110.484 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt -66.93 -40.96 87.75 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.796 -0.638 . . . . 292.18 110.493 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.74 -40.73 99.57 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.626 -0.715 . . . . 65.97 112.178 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.96 -39.77 93.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.636 0.255 . . . . 184.99 110.933 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.05 -40.48 94.8 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.254 -0.43 . . . . 381.14 110.595 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.93 -42.57 96.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.897 -0.592 . . . . 354.06 110.348 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -65.05 -17.33 63.27 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.787 -0.642 . . . . 88.8 113.437 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -80.09 -13.03 59.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.987 0.394 . . . . 999.99 111.178 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -107.48 112.1 24.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 999.99 110.282 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 78.2 mt -125.4 125.95 69.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.292 -0.413 . . . . 458.46 110.746 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -130.6 48.53 2.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.077 0.465 . . . . 388.05 110.516 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.45 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 67.2 mtt -66.77 -35.54 80.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.654 -0.703 . . . . 538.07 111.661 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.4 -38.12 79.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.32 -0.4 . . . . 282.7 111.33 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -59.27 -47.13 86.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.272 -0.422 . . . . 999.99 110.397 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -58.62 -48.26 81.59 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.106 -0.497 . . . . 504.74 111.249 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.45 ' HD1' ' O ' ' A' ' 98' ' ' MET . 58.1 m-85 -62.81 -41.63 99.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.768 0.318 . . . . 999.99 110.985 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -64.23 -43.6 94.45 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.076 -0.511 . . . . 558.87 111.224 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.77 -41.36 97.6 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.154 -0.475 . . . . 412.73 111.721 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.91 -48.48 76.43 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.465 -0.334 . . . . 665.66 111.08 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.94 -40.21 95.91 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.678 0.275 . . . . 999.99 111.283 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.62 -44.67 90.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.19 -0.459 . . . . 746.24 111.959 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -86.53 -11.26 52.13 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.897 0.332 . . . . 999.99 111.897 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.07 39.94 31.73 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.397 0.435 . . . . 848.93 111.778 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mmm -109.68 108.8 19.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.871 0.367 . . . . 999.99 111.483 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.46 120.02 65.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 586.78 110.126 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.61 146.14 54.12 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.279 1.986 . . . . 310.73 112.754 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -84.94 142.26 29.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 866.09 110.692 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -69.34 109.6 4.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.401 -0.363 . . . . 999.99 110.969 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.59 126.02 40.64 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.437 -0.347 . . . . 579.24 111.011 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -56.91 -32.63 93.05 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.042 2.495 . . . . 684.25 112.355 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -59.74 -45.28 92.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.758 -0.655 . . . . 662.15 111.642 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 77.9 mtm -60.16 -40.89 91.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.695 0.283 . . . . 999.99 110.253 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 55.2 tp10 -60.79 -43.0 98.68 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.976 -0.557 . . . . 675.31 110.104 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 124' ' ' MET . 88.9 tt0 -61.62 -44.74 96.43 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.813 -0.63 . . . . 900.95 110.973 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.8 mm -61.53 -43.74 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 CA-C-N 116.419 -0.355 . . . . 500.83 111.392 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -61.8 -38.66 88.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.624 0.25 . . . . 834.99 111.474 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -66.44 -32.66 74.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.338 -0.392 . . . . 999.99 111.771 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.494 ' HG2' ' O ' ' A' ' 120' ' ' GLU . 26.5 mmt -70.43 141.31 52.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.503 -0.317 . . . . 599.62 111.416 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.483 ' O ' HG21 ' A' ' 129' ' ' VAL . 95.7 mtm-85 -52.26 139.46 35.98 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 115.776 -0.647 . . . . 999.99 111.044 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -60.44 -25.97 81.7 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.734 2.289 . . . . 214.74 112.794 -179.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.425 ' HA ' ' CG1' ' A' ' 17' ' ' VAL . . . -62.22 -36.7 82.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 248.66 111.43 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -92.12 -0.09 57.45 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.191 0.441 . . . . 360.37 112.191 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . 0.483 HG21 ' O ' ' A' ' 125' ' ' ARG . 63.0 t -89.59 117.55 68.25 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.692 0.282 . . . . 334.76 111.305 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -72.83 160.85 45.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.814 2.343 . . . . 351.83 112.388 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 92.3 t -106.18 137.19 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.936 0.398 . . . . 410.42 110.444 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -96.4 126.94 41.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 999.99 110.891 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -82.76 149.66 27.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 551.94 110.15 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.3 mmt . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.471 -0.776 . . . . 965.93 110.767 -179.718 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.9 mtt85 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 113.715 1.006 . . . . 999.99 113.715 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.1 m -130.66 141.8 50.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.768 -0.196 . . . . 999.99 110.827 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 9.0 t-105 -157.51 142.29 16.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 999.99 110.393 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.05 -39.26 93.03 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.697 0.628 . . . . 999.99 112.697 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -87.05 -90.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.159 0.429 . . . . 999.99 112.159 -178.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.0 122.84 70.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 521.04 111.037 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.29 126.49 60.36 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.967 -0.561 . . . . 999.99 110.704 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -56.55 134.66 65.79 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.712 2.275 . . . . 546.56 112.2 179.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -125.59 -47.07 1.71 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.465 -0.334 . . . . 999.99 111.838 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -105.28 -7.79 18.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.327 0.491 . . . . 999.99 112.327 -178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 92.0 mt -58.81 138.99 56.93 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.886 0.374 . . . . 999.99 111.573 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -100.3 118.51 36.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 280.85 110.179 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -61.6 -38.94 89.43 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.003 -0.544 . . . . 999.99 111.643 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.03 87.29 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.856 0.36 . . . . 200.79 111.396 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -70.07 -30.72 68.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 518.33 110.03 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -64.38 -39.05 93.11 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.746 -0.661 . . . . 524.44 109.526 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.31 -44.88 96.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.51 -0.768 . . . . 407.88 111.017 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.539 ' O ' HG11 ' A' ' 21' ' ' VAL . . . -61.89 -38.77 89.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.151 0.501 . . . . 136.03 110.397 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.6 -39.61 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.759 -0.655 . . . . 505.3 111.085 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.23 -41.24 92.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.81 0.671 . . . . 703.51 112.81 -178.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.539 HG11 ' O ' ' A' ' 18' ' ' ALA . 9.9 p -66.03 -36.36 77.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 120.719 -0.393 . . . . 324.41 111.208 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.422 ' OE1' ' HA ' ' A' ' 86' ' ' THR . 63.1 tt0 -67.02 -39.98 87.15 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.101 0.477 . . . . 685.46 110.249 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.683 HG23 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -62.89 -43.52 98.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 115.544 -0.753 . . . . 238.49 110.436 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.8 mm -60.09 -43.91 93.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-N 115.511 -0.768 . . . . 509.15 111.775 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.96 95.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.013 0.375 . . . . 183.06 112.013 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.3 -42.83 95.95 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.731 -0.747 . . . . 63.82 113.103 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -74.69 -19.81 60.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.056 0.391 . . . . 351.91 112.056 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.454 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.7 t0 -76.42 -39.48 53.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.738 -0.21 . . . . 145.09 111.182 -178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -62.55 -43.33 99.08 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.947 0.403 . . . . 999.99 109.944 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.31 -39.58 94.37 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.691 -0.686 . . . . 82.9 112.225 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -63.24 -42.56 99.24 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 122.33 0.252 . . . . 392.81 111.209 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 28' ' ' ASP . 63.0 t -60.94 -46.03 97.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.567 -0.288 . . . . 455.7 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -63.17 -41.25 99.2 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.848 0.356 . . . . 756.66 110.636 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -63.92 -44.13 93.83 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.337 0.589 . . . . 999.99 109.978 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.7 tp -60.77 -39.07 87.43 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.104 -0.953 . . . . 373.99 111.42 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -64.4 -25.01 67.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.907 0.336 . . . . 811.35 111.907 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.3 t -86.81 -51.06 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 N-CA-C 113.128 0.788 . . . . 461.27 113.128 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.643 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.1 m-70 -98.98 -4.03 33.56 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.737 0.643 . . . . 575.93 112.737 -178.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.49 -34.9 70.16 Favored Glycine 0 N--CA 1.46 0.289 0 CA-C-N 116.169 -0.468 . . . . 226.53 114.086 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -62.26 -19.91 63.71 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.098 0.407 . . . . 999.99 112.098 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 70.2 p -111.69 -13.06 13.8 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.792 0.664 . . . . 432.8 112.792 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 95.1 mt -72.96 137.27 45.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.804 0.335 . . . . 844.62 111.815 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.5 p -78.04 165.47 23.98 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.305 -0.407 . . . . 316.62 110.359 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.8 m -61.76 -44.15 97.45 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.771 0.319 . . . . 291.13 111.188 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 70.6 t -66.91 -43.69 89.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.219 -0.446 . . . . 467.63 111.035 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.463 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 64.9 tt0 -63.11 -40.78 98.62 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.453 . . . . 430.34 111.12 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.36 -47.12 87.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.311 -0.404 . . . . 667.57 111.241 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.88 -40.38 95.02 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.906 0.384 . . . . 527.8 110.914 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.68 86.13 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.711 -0.677 . . . . 169.13 111.647 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 83.9 mt -60.61 -35.63 76.61 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.899 0.703 . . . . 409.47 112.899 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -59.67 -41.24 90.16 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.969 -0.382 . . . . 686.82 109.969 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -68.69 -39.41 80.53 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.217 -0.447 . . . . 213.85 109.898 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.4 t -60.32 -41.29 86.64 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 CA-C-N 115.877 -0.601 . . . . 289.44 110.442 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -59.11 -42.43 90.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.427 -0.351 . . . . 358.19 110.394 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.642 ' O ' ' HG2' ' A' ' 58' ' ' MET . 98.7 mtt180 -64.77 -42.54 95.04 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.18 -0.464 . . . . 999.99 110.439 178.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -65.31 -42.71 92.72 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.496 0.665 . . . . 999.99 110.633 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -60.59 -47.02 88.05 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.96 -1.018 . . . . 212.58 111.865 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.683 ' SD ' HG23 ' A' ' 23' ' ' ILE . 14.0 ptt? -58.98 -39.27 81.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.745 0.307 . . . . 262.65 110.852 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.445 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 98.3 mm-40 -69.63 -39.05 77.39 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.189 -0.46 . . . . 684.75 111.2 179.055 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.7 m -61.44 -48.01 83.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.288 -0.414 . . . . 450.86 110.959 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.6 -48.53 79.0 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.083 -0.508 . . . . 587.54 110.827 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.4 t-105 -64.85 -40.24 94.84 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.912 0.708 . . . . 785.5 112.912 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 59' ' ' GLN . . . -56.93 -37.9 72.13 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.915 0.709 . . . . 290.18 112.915 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.68 -46.97 87.46 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.674 0.273 . . . . 676.15 110.977 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -77.83 -41.1 38.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.418 -0.355 . . . . 824.3 111.127 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.6 ttt -53.6 -45.02 69.88 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.013 0.745 . . . . 839.61 113.013 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.2 tp -57.81 -45.46 86.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.014 0.375 . . . . 667.86 112.014 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -65.56 -40.87 93.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 999.99 111.172 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mm -70.63 -42.97 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.115 -0.493 . . . . 648.32 111.082 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -60.66 -38.9 86.41 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.805 -0.634 . . . . 555.82 111.925 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.22 -46.33 88.76 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 110.261 -0.274 . . . . 912.86 110.261 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.79 -41.28 92.18 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.357 -0.383 . . . . 999.99 111.071 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.05 -45.69 98.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.381 -0.372 . . . . 322.08 110.998 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.85 -43.1 99.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.175 -0.466 . . . . 443.19 111.124 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.51 -40.26 96.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.348 -0.387 . . . . 427.97 111.09 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.58 -38.54 80.78 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.169 -0.469 . . . . 552.67 111.343 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.7 5.02 75.16 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.952 -0.642 . . . . 282.78 112.48 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -74.18 147.56 42.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.867 0.365 . . . . 999.99 111.269 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -102.9 109.39 61.23 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 423.41 110.812 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -59.43 138.44 84.17 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.746 2.297 . . . . 262.13 112.549 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.9 m -102.37 172.61 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.447 . . . . 322.52 111.692 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.3 t -61.16 -41.13 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 115.68 -0.691 . . . . 195.73 110.97 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.536 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.02 -41.88 98.14 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.782 -0.723 . . . . 116.64 112.398 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.84 -40.13 94.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.128 0.489 . . . . 397.23 110.216 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -66.63 -39.88 88.48 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.517 -0.765 . . . . 273.3 111.591 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.536 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.9 OUTLIER -64.22 -34.33 77.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.988 -0.285 . . . . 391.43 111.025 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.73 -40.99 92.74 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.212 0.529 . . . . 999.99 109.593 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.98 -38.61 86.38 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.327 -0.851 . . . . 292.18 110.476 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.99 -39.18 95.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.621 -0.718 . . . . 65.97 113.067 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.7 97.12 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.895 0.379 . . . . 184.99 110.2 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.4 -40.39 89.58 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.839 -0.619 . . . . 381.14 110.363 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -61.61 -45.6 98.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.729 -0.669 . . . . 354.06 111.321 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -81.9 -2.56 90.59 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.937 -0.649 . . . . 88.8 113.64 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -79.45 -30.67 42.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.123 0.461 . . . . 999.99 110.953 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -108.63 112.65 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.512 -0.313 . . . . 999.99 110.937 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.7 mm -124.89 125.55 69.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.585 -0.524 . . . . 458.46 109.585 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -141.76 68.97 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.894 0.378 . . . . 388.05 111.582 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.3 mmm -70.97 -28.21 64.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.86 -0.609 . . . . 538.07 111.192 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.21 -38.16 82.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.66 -0.7 . . . . 282.7 112.031 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -59.24 -48.8 80.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.4 -0.363 . . . . 999.99 111.135 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -60.01 -46.81 88.26 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.585 -0.279 . . . . 504.74 110.962 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -58.44 -47.44 83.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.037 -0.529 . . . . 999.99 111.141 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.7 -46.08 91.75 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.578 -0.283 . . . . 558.87 110.804 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.16 98.08 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.256 -0.429 . . . . 412.73 111.378 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.49 -45.23 93.96 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.981 -0.554 . . . . 665.66 110.956 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -62.75 -39.31 93.71 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.243 -0.435 . . . . 999.99 110.782 179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.13 -40.95 82.61 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.962 -0.563 . . . . 746.24 111.39 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -83.41 -11.73 57.25 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.518 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.5 t30 54.06 45.99 26.39 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 122.96 0.504 . . . . 848.93 111.781 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.4 mtp -107.91 113.85 27.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.881 0.372 . . . . 999.99 111.361 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.8 mt -94.33 118.73 67.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 586.78 110.185 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.66 139.51 34.11 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.307 2.005 . . . . 310.73 112.97 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -86.07 141.27 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 866.09 110.692 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -68.66 119.93 13.86 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.714 0.292 . . . . 999.99 110.615 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -98.59 123.83 48.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.47 -0.332 . . . . 579.24 111.322 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -57.83 -31.74 93.19 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.953 2.435 . . . . 684.25 112.449 178.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -61.24 -28.17 68.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.696 -0.684 . . . . 662.15 111.702 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.06 -37.66 80.53 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.337 -0.392 . . . . 999.99 111.093 -179.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.58 -40.32 91.28 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 675.31 110.933 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.27 -40.55 96.22 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.475 -0.329 . . . . 900.95 110.978 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.2 mm -61.43 -45.72 98.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.152 -0.477 . . . . 500.83 110.673 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -39.1 93.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.817 -0.628 . . . . 834.99 111.995 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 54.8 mmm-85 -67.72 -34.25 76.49 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.2 ptp -81.3 151.02 28.25 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.129 0.49 . . . . 599.62 112.252 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -51.75 134.52 36.54 Favored Pre-proline 0 N--CA 1.466 0.353 0 CA-C-N 115.285 -0.87 . . . . 999.99 111.457 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -53.12 -32.59 59.94 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.303 2.668 . . . . 214.74 113.171 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.07 -36.25 76.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 248.66 111.663 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -91.87 8.14 38.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.453 -0.34 . . . . 360.37 111.736 -179.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 72.8 t -91.43 114.78 62.87 Favored Pre-proline 0 C--O 1.234 0.244 0 CA-C-O 120.818 0.342 . . . . 334.76 110.965 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.46 157.59 49.02 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.676 2.251 . . . . 351.83 112.772 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.445 ' HB ' ' HG3' ' A' ' 59' ' ' GLN . 16.7 m -126.84 158.82 37.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.074 -0.512 . . . . 410.42 110.593 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -113.98 128.94 56.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.881 0.372 . . . . 999.99 111.297 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -83.17 161.62 21.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.928 -0.578 . . . . 551.94 109.985 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.173 -0.918 . . . . 965.93 110.687 -179.411 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--O 1.232 0.159 0 N-CA-C 110.031 -0.359 . . . . 375.52 110.031 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -91.11 116.1 65.74 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.682 -0.236 . . . . 999.99 110.418 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' OD1' ' A' ' 74' ' ' ASP . 59.9 Cg_endo -72.4 140.2 33.04 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.135 . . . . 436.63 112.783 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -99.68 -12.7 19.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 999.99 111.17 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -107.98 10.79 28.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.087 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.05 124.62 19.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.856 -0.611 . . . . 781.6 111.909 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.522 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.5 t-20 -109.98 110.34 21.23 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.311 -0.626 . . . . 216.75 109.311 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.08 -39.34 92.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.294 0.479 . . . . 902.9 112.294 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.83 -41.21 90.83 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.95 0.352 . . . . 121.35 111.95 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -72.56 -27.71 62.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.411 -0.358 . . . . 265.05 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 12' ' ' ASN . 78.2 mm-40 -63.97 -40.04 95.51 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.104 -0.498 . . . . 524.44 112.115 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 14' ' ' ALA . 9.3 p -67.27 -36.07 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 120.757 -0.377 . . . . 214.56 110.938 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.84 -42.61 99.81 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.195 0.521 . . . . 61.91 109.98 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.6 tp -66.08 -42.68 89.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.23 -0.895 . . . . 321.59 110.758 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.16 -41.75 93.45 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.588 -0.733 . . . . 491.97 111.603 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' VAL . 65.7 t -63.15 -43.09 98.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 116.61 -0.268 . . . . 179.68 111.067 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.08 -40.97 97.41 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.884 0.374 . . . . 483.12 110.564 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.58 -43.92 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 115.829 -0.623 . . . . 120.91 111.025 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.3 mt -61.02 -44.16 97.64 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 116.124 -0.489 . . . . 324.41 111.388 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.13 -43.52 95.63 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.58 0.229 . . . . 76.38 111.222 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.78 -39.39 96.59 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 121.146 -0.549 . . . . 59.56 112.435 178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -72.38 -20.59 61.42 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.6 0.36 . . . . 169.43 111.718 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -78.1 -23.57 47.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.183 -0.207 . . . . 145.09 111.535 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' VAL . 95.6 mtt-85 -65.48 -42.48 92.17 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.089 0.471 . . . . 779.77 110.026 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -25.14 73.58 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.722 -0.672 . . . . 72.33 112.636 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.0 tp -63.09 -44.68 95.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.592 0.234 . . . . 213.67 111.248 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.565 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.0 p -66.41 -31.73 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.462 -0.335 . . . . 275.82 111.137 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.51 -40.58 95.9 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.971 0.415 . . . . 545.0 110.258 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.3 t90 -67.07 -38.94 86.66 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.706 -0.679 . . . . 999.99 109.292 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 32' ' ' VAL . 92.5 mt -61.37 -36.34 79.97 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.029 -0.987 . . . . 205.93 111.298 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -65.5 -21.27 66.61 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.058 0.392 . . . . 557.46 112.058 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 63.6 t -86.43 -47.59 16.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 112.521 0.563 . . . . 284.57 112.521 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.14 17.23 21.84 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.279 0.474 . . . . 350.44 112.279 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.81 -39.29 96.6 Favored Glycine 0 CA--C 1.518 0.239 0 N-CA-C 114.446 0.538 . . . . 199.7 114.446 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.2 ptt180 -63.27 -26.32 68.72 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.492 0.553 . . . . 999.99 112.492 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.543 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.1 p -113.15 8.11 18.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.96 0.356 . . . . 302.8 111.96 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.4 tp -72.39 121.98 20.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.805 0.336 . . . . 581.97 111.535 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.6 p -80.78 169.24 17.84 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.385 -0.371 . . . . 239.07 110.258 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.3 m -62.38 -43.96 97.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.741 0.305 . . . . 192.01 111.209 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -28.42 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 278.45 112.539 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 15.0 mm100 -62.71 -39.45 94.08 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.42 0.155 . . . . 316.42 111.42 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -60.57 -46.84 88.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.86 0.362 . . . . 470.35 110.202 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.91 -38.6 86.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.872 -0.604 . . . . 369.78 110.794 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.01 81.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.662 -0.699 . . . . 66.79 111.496 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.4 mt -60.88 -36.41 79.12 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.158 -0.474 . . . . 238.3 111.796 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -61.07 -39.49 90.1 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.372 -0.603 . . . . 526.93 109.372 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -65.97 -40.94 91.71 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.619 -0.719 . . . . 162.88 109.603 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.42 HG13 ' CE2' ' A' ' 101' ' ' PHE . 55.3 t -61.57 -41.97 92.28 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 115.729 -0.669 . . . . 139.01 110.448 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -59.49 -41.65 90.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.927 -0.579 . . . . 198.61 110.821 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.2 -41.95 96.84 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.068 -0.253 . . . . 999.99 110.619 178.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -64.79 -40.23 94.9 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.29 0.567 . . . . 799.65 109.982 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -60.42 -46.62 89.37 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.083 -0.962 . . . . 151.58 110.234 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ttt -59.11 -43.65 91.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.772 -0.649 . . . . 168.43 110.795 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -62.72 -42.61 99.74 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.799 0.333 . . . . 530.56 110.993 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.1 m -68.32 -42.89 78.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.22 0.533 . . . . 293.49 110.861 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.419 ' NE2' ' HE1' ' A' ' 65' ' ' TYR . 71.7 t60 -63.27 -38.74 92.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.512 -0.767 . . . . 383.72 110.759 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -55.95 -32.66 64.04 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.893 -0.594 . . . . 497.0 112.553 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.74 -38.68 78.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 177.0 111.681 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -43.46 97.45 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.897 0.379 . . . . 478.76 111.73 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.419 ' HE1' ' NE2' ' A' ' 61' ' ' HIS . 76.8 m-85 -84.74 -20.45 31.07 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.706 0.632 . . . . 727.09 112.706 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.7 ttt -50.92 -50.19 58.16 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.568 0.581 . . . . 664.46 112.568 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 87.3 mt -64.6 -41.9 95.92 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 111.9 0.333 . . . . 447.74 111.9 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -71.26 -52.76 17.15 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.398 0.888 . . . . 999.99 113.398 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.1 mt -84.85 -60.09 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 114.752 1.39 . . . . 398.95 114.752 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.23 -42.19 99.21 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.373 1.249 . . . . 366.97 114.373 -175.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 40.2 ttpt -62.22 -45.91 91.24 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.739 -0.384 . . . . 709.01 111.297 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -65.13 -42.43 93.86 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.92 0.341 . . . . 931.14 111.92 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.2 mt -62.88 -46.78 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.628 0.251 . . . . 175.26 111.203 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 36.6 t70 -63.0 -45.6 91.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.355 -0.384 . . . . 443.19 111.468 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.01 -40.63 96.78 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.069 0.396 . . . . 366.44 112.069 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.14 -39.18 79.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.319 . . . . 386.93 111.522 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.03 -3.47 84.55 Favored Glycine 0 CA--C 1.518 0.27 0 C-N-CA 120.844 -0.693 . . . . 244.67 112.311 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -74.15 149.87 40.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.826 0.346 . . . . 999.99 111.036 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.0 p -112.63 95.31 32.03 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.338 -0.392 . . . . 263.29 111.059 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.86 146.08 98.06 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.061 2.507 . . . . 173.89 112.463 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.92 -179.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.232 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.69 -42.33 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.28 -0.418 . . . . 81.09 111.157 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.563 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.58 -40.45 97.87 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.682 -0.771 . . . . 106.63 112.143 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.81 -40.95 96.05 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.902 0.382 . . . . 397.23 110.718 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -68.55 -37.69 80.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.868 -0.605 . . . . 176.41 112.278 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -61.48 -35.15 76.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.917 -0.313 . . . . 224.32 111.077 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.2 mmm180 -66.75 -40.65 88.39 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.171 0.51 . . . . 999.99 110.092 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.46 -38.89 88.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.499 -0.773 . . . . 158.17 110.585 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.65 -39.04 96.01 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.536 -0.756 . . . . 65.71 112.615 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.07 96.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.617 0.246 . . . . 95.38 110.802 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -66.25 -41.67 89.66 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.98 0.419 . . . . 381.14 110.335 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.01 -43.41 97.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.931 -0.577 . . . . 182.12 110.796 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -79.08 -2.05 86.42 Favored Glycine 0 CA--C 1.519 0.342 0 CA-C-N 116.022 -0.535 . . . . 88.8 113.43 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -77.38 -31.34 54.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 999.99 110.709 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -103.48 112.55 25.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 999.99 110.152 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.5 mt -128.18 124.01 61.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.367 -0.379 . . . . 308.67 110.059 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -140.46 70.96 1.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.887 0.375 . . . . 388.05 111.097 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 61.8 mtt -70.31 -28.17 64.96 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.969 -0.559 . . . . 360.57 111.19 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.24 82.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.918 -0.583 . . . . 184.23 111.285 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -59.52 -47.82 84.03 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.241 -0.436 . . . . 999.99 110.83 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.42 ' CE2' HG13 ' A' ' 53' ' ' VAL . 43.4 t80 -60.29 -47.76 84.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.345 -0.389 . . . . 374.13 110.304 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -59.83 -47.87 83.96 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.765 -0.652 . . . . 999.99 111.154 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -60.84 -46.7 89.53 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.41 -0.359 . . . . 558.87 111.255 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.83 98.69 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.459 -0.337 . . . . 332.85 111.388 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.25 -44.27 92.29 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.077 -0.51 . . . . 472.21 110.783 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -63.68 -41.91 98.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.673 -0.694 . . . . 821.44 110.952 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.83 -42.83 85.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.09 -0.504 . . . . 746.24 112.171 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -88.43 -7.9 55.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.173 -0.211 . . . . 999.99 111.493 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.04 39.04 31.43 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.081 0.771 . . . . 675.44 113.081 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.15 61.26 1.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.882 0.373 . . . . 999.99 110.743 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.0 mt -82.13 121.7 79.01 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.222 -0.445 . . . . 390.38 110.699 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.94 152.73 63.44 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.563 2.176 . . . . 243.11 112.548 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -74.79 136.3 41.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 618.1 110.767 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -69.58 90.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 999.99 110.963 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.16 145.36 29.87 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.009 -0.541 . . . . 415.25 111.564 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.06 -30.28 47.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.555 2.17 . . . . 529.15 112.35 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -63.29 -45.48 91.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.102 -0.499 . . . . 516.88 110.185 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 98.1 mtp -62.36 -40.24 95.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.927 -0.579 . . . . 914.6 110.164 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.26 -41.6 97.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.535 -0.757 . . . . 675.31 110.535 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.22 -39.42 93.93 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.838 -0.619 . . . . 900.95 110.883 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 90.0 mt -61.51 -44.0 97.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 116.086 -0.506 . . . . 300.73 110.872 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.08 -36.38 83.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 595.29 111.147 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -70.54 -16.12 62.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 999.99 112.229 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 75.1 mtm -69.93 140.07 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.973 -0.291 . . . . 385.68 110.811 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 129' ' ' VAL . 59.6 ttp180 -51.41 129.82 33.57 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.857 -0.611 . . . . 999.99 111.367 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -53.15 -34.74 70.18 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.383 2.722 . . . . 149.6 113.326 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.51 76.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 147.02 111.838 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -91.11 0.48 57.53 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.946 0.35 . . . . 360.37 111.946 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 125' ' ' ARG . 58.4 t -98.19 111.11 58.72 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.715 0.293 . . . . 187.93 111.138 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.39 151.03 82.24 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.084 2.523 . . . . 265.39 112.301 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.98 142.72 32.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.984 0.421 . . . . 246.78 110.704 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -132.78 148.14 52.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.91 -0.586 . . . . 999.99 110.557 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -83.99 173.92 10.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 495.41 110.349 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.237 -0.887 . . . . 761.34 110.921 -178.94 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.437 -0.209 . . . . 375.52 110.437 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.76 129.25 65.9 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.599 -0.273 . . . . 999.99 110.311 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.73 130.03 15.28 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.315 2.01 . . . . 436.63 113.258 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -124.84 1.69 8.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 999.99 110.918 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -104.73 8.93 35.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.376 . . . . 999.99 111.81 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.3 mt -56.78 113.7 1.76 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.893 0.378 . . . . 781.6 111.767 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -114.37 115.01 26.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.722 -0.473 . . . . 216.75 109.722 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -61.7 -39.76 92.59 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.474 -0.33 . . . . 902.9 111.74 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -40.41 89.34 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.968 0.413 . . . . 121.35 111.644 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -71.35 -31.39 67.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.095 -0.502 . . . . 265.05 110.492 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -65.14 -41.19 95.03 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.824 -0.626 . . . . 524.44 112.016 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.749 HG11 ' HA ' ' A' ' 127' ' ' ALA . 18.7 m -73.99 -29.83 26.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.731 -0.388 . . . . 214.56 111.455 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.92 -40.04 95.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.561 0.696 . . . . 61.91 109.262 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HA3' ' A' ' 89' ' ' GLY . 61.2 tp -64.64 -39.64 94.06 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.712 -1.131 . . . . 321.59 111.082 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 98.2 mttt -59.58 -40.5 87.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.191 -0.459 . . . . 491.97 111.155 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.537 ' O ' HG22 ' A' ' 24' ' ' ILE . 77.6 t -65.42 -44.32 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.879 0.371 . . . . 179.68 111.199 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -66.12 -42.23 89.47 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.775 0.657 . . . . 483.12 112.775 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 19' ' ' LEU . 44.0 pt -81.42 -27.64 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 113.394 0.887 . . . . 120.91 113.394 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.537 HG22 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -58.43 -35.73 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.534 0.207 . . . . 324.41 111.513 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.66 92.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 76.38 111.237 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.57 -41.74 89.47 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.158 -0.544 . . . . 59.56 112.828 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 37.8 m-85 -71.17 -24.97 62.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.635 0.235 . . . . 169.43 111.635 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.434 ' O ' HG23 ' A' ' 32' ' ' VAL . 34.7 t70 -75.45 -38.84 59.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.719 -0.219 . . . . 145.09 110.899 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.58 -41.28 98.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.924 0.392 . . . . 779.77 110.01 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.81 -39.97 96.99 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.732 -0.667 . . . . 72.33 112.275 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' PHE . 86.4 mt -64.59 -38.81 92.3 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.466 0.173 . . . . 213.67 111.466 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 28' ' ' ASP . 60.6 t -60.25 -46.0 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.67 -0.241 . . . . 275.82 110.878 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -63.59 -40.59 97.33 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.052 0.454 . . . . 545.0 110.389 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CH2' HD11 ' A' ' 42' ' ' LEU . 87.3 t90 -64.49 -42.24 95.97 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.695 -0.684 . . . . 999.99 110.279 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.9 mt -61.98 -36.94 82.99 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.816 -0.629 . . . . 205.93 111.296 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -61.6 -37.61 84.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.708 0.29 . . . . 557.46 111.275 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.4 t -87.35 -50.51 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 113.378 0.881 . . . . 284.57 113.378 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.576 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.13 -29.46 8.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.251 0.834 . . . . 350.44 113.251 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.56 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.7 -35.09 84.93 Favored Glycine 0 N--CA 1.462 0.37 0 CA-C-N 116.588 -0.278 . . . . 199.7 113.793 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -58.2 -39.49 79.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.961 0.356 . . . . 999.99 111.961 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.9 p -87.3 -10.15 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.749 0.648 . . . . 302.8 112.749 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 98.0 mt -73.39 150.98 41.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.134 0.492 . . . . 581.97 111.963 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.4 m -77.08 162.79 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.673 . . . . 239.07 110.565 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.5 m -59.9 -41.13 90.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.216 -0.447 . . . . 192.01 111.187 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.431 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 77.8 t -65.64 -41.71 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.27 -0.423 . . . . 278.45 110.642 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.94 -39.84 95.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.085 -0.507 . . . . 316.42 110.913 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -61.83 -44.25 97.22 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.238 -0.437 . . . . 470.35 110.789 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -39.31 93.84 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.277 -0.42 . . . . 369.78 110.92 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -23.89 66.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.777 -0.647 . . . . 66.79 112.149 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.2 -37.36 82.7 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.285 0.476 . . . . 238.3 112.285 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -59.01 -46.94 86.93 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.157 -0.683 . . . . 526.93 109.157 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -62.21 -44.23 97.04 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.422 -0.808 . . . . 162.88 110.421 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.4 t -61.15 -42.46 93.38 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 CA-C-N 116.451 -0.341 . . . . 139.01 110.492 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.45 -40.33 90.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.229 -0.441 . . . . 198.61 111.051 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -61.15 -46.96 88.38 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.001 -0.37 . . . . 999.99 110.001 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -64.73 -39.37 93.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.375 0.607 . . . . 799.65 110.21 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' A' ' 96' ' ' ILE . 90.9 t80 -58.36 -47.75 82.81 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.121 -0.945 . . . . 151.58 110.586 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.0 ttt -60.48 -45.24 94.48 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 168.43 110.816 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.66 ' HG2' HG13 ' A' ' 131' ' ' VAL . 53.0 mt-30 -62.32 -39.26 92.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 530.56 111.653 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.9 m -60.51 -48.24 82.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.397 -0.365 . . . . 293.49 110.976 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.478 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 82.7 m-70 -70.22 -39.13 75.29 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.425 -0.352 . . . . 383.72 111.204 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -61.4 -45.43 94.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.966 -0.561 . . . . 497.0 111.452 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.28 87.56 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 111.729 0.27 . . . . 177.0 111.729 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -62.78 -46.08 89.66 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.928 0.394 . . . . 478.76 111.129 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.478 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 48.9 m-85 -70.68 -33.82 71.32 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.137 -0.483 . . . . 727.09 111.761 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 1.8 mmt -49.09 -41.33 35.31 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.909 0.707 . . . . 664.46 112.909 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.4 mt -61.96 -43.91 97.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.718 0.294 . . . . 447.74 111.111 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -70.17 -43.93 69.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 999.99 111.051 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 73' ' ' ILE . 97.2 mt -63.65 -47.92 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 115.619 -0.719 . . . . 398.95 111.922 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -62.55 -40.64 97.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.317 -0.401 . . . . 366.97 111.685 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.7 -46.8 89.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.671 -0.24 . . . . 709.01 110.918 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -65.85 -41.79 91.28 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.555 -0.293 . . . . 931.14 111.529 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.9 mm -65.16 -46.38 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.491 -0.322 . . . . 175.26 111.04 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -62.99 -43.61 98.31 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.269 -0.423 . . . . 443.19 111.783 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.26 97.0 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.459 -0.337 . . . . 366.44 111.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.66 -42.62 50.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.028 0.442 . . . . 386.93 111.012 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.89 -14.69 64.56 Favored Glycine 0 CA--C 1.518 0.234 0 CA-C-N 115.845 -0.616 . . . . 244.67 112.431 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -75.57 139.06 41.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.596 0.236 . . . . 999.99 110.85 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 68.7 p -75.36 139.4 71.7 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.747 -0.206 . . . . 263.29 110.653 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.47 142.56 33.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.423 2.082 . . . . 173.89 112.924 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.532 HG23 ' H ' ' A' ' 84' ' ' ASP . 18.6 m -102.87 171.42 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.503 . . . . 201.66 111.095 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 76.8 t -60.78 -42.52 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.305 -0.407 . . . . 81.09 110.52 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.31 96.02 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.957 -0.64 . . . . 106.63 112.234 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.532 ' H ' HG23 ' A' ' 81' ' ' VAL . 38.1 t70 -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.826 0.346 . . . . 397.23 110.178 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.419 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 28.2 m-85 -62.96 -41.78 99.63 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.935 -0.575 . . . . 176.41 111.226 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 77.2 p -68.03 -36.37 79.82 Favored 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 111.847 0.314 . . . . 224.32 111.847 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.9 -41.66 95.41 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.032 0.444 . . . . 999.99 110.15 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -69.37 -39.02 78.29 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.629 -0.714 . . . . 158.17 110.205 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.52 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.19 -36.73 93.41 Favored Glycine 0 C--N 1.333 0.365 0 CA-C-N 115.176 -0.92 . . . . 65.71 113.175 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.9 85.08 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.427 0.156 . . . . 95.38 111.209 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.97 -40.66 96.35 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.969 0.414 . . . . 381.14 110.252 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -64.53 -43.58 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.828 -0.624 . . . . 182.12 110.545 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . -64.44 -22.45 67.62 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.719 -0.673 . . . . 88.8 113.95 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.2 -14.2 58.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.034 0.417 . . . . 999.99 111.489 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.75 115.38 29.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.632 0.253 . . . . 999.99 110.866 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.492 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 43.4 pt -129.78 147.44 33.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.996 0.427 . . . . 308.67 111.241 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -148.08 34.98 0.82 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.0 -0.546 . . . . 388.05 110.976 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.9 mmm -61.95 -39.5 92.32 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.189 -0.46 . . . . 360.57 111.382 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.7 88.98 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.174 -0.466 . . . . 184.23 111.104 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -68.94 -30.94 69.49 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.756 -0.656 . . . . 999.99 111.666 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.78 -49.65 76.88 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.751 0.31 . . . . 374.13 110.833 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -66.87 -37.14 83.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.462 -0.335 . . . . 999.99 111.309 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.97 -44.46 97.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.415 -0.357 . . . . 558.87 110.385 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.18 -41.65 99.24 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.029 -0.532 . . . . 332.85 111.114 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.05 -41.49 90.74 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.07 -0.514 . . . . 472.21 110.754 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -62.55 -41.12 98.69 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.119 -0.491 . . . . 821.44 110.65 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.56 -40.2 78.36 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.975 -0.557 . . . . 746.24 111.314 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.2 -4.42 59.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.313 -0.403 . . . . 999.99 111.04 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 57.64 39.85 27.15 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.851 -0.613 . . . . 675.44 111.428 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 98.7 mmm -108.36 114.25 27.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.424 -0.353 . . . . 999.99 111.321 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.1 mt -94.44 118.99 66.96 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 390.38 109.831 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.72 126.72 12.31 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.019 1.812 . . . . 243.11 113.053 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -87.11 156.41 19.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.768 -0.651 . . . . 618.1 110.774 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.431 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 75.4 t80 -67.27 125.92 27.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.025 -0.361 . . . . 999.99 110.025 178.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.3 mt -98.62 138.08 20.71 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.535 -0.302 . . . . 415.25 111.363 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.84 -23.17 55.48 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.655 2.237 . . . . 529.15 111.861 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -63.84 -30.17 71.29 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.559 -0.746 . . . . 516.88 110.822 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.6 mtt -60.13 -39.16 85.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.962 -0.563 . . . . 914.6 110.66 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -61.09 -40.87 95.35 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.215 -0.448 . . . . 675.31 110.69 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.27 -41.11 97.07 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.137 -0.483 . . . . 900.95 111.069 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.98 -44.53 99.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.351 -0.386 . . . . 300.73 110.816 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.54 -39.63 94.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.392 -0.367 . . . . 595.29 111.632 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -68.01 -33.43 74.6 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.206 0.447 . . . . 999.99 112.206 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -83.33 130.45 35.06 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.08 0.4 . . . . 385.68 112.08 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -53.6 145.66 28.41 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 115.731 -0.668 . . . . 999.99 111.117 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -27.47 84.92 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.609 2.206 . . . . 149.6 112.618 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.749 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -71.07 -19.75 62.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 147.02 111.29 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -103.5 12.69 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.334 -0.394 . . . . 360.37 111.194 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.4 t -98.82 110.43 57.33 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.834 0.35 . . . . 187.93 110.696 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.94 166.59 26.58 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.091 2.527 . . . . 265.39 112.957 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.66 HG13 ' HG2' ' A' ' 59' ' ' GLN . 64.7 t -107.37 136.33 42.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.047 -0.723 . . . . 246.78 109.047 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -115.67 131.11 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.875 0.369 . . . . 999.99 110.191 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -76.53 158.58 31.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.304 0.573 . . . . 495.41 112.21 -178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 74.3 mmm . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.264 -0.874 . . . . 761.34 111.526 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.086 0.47 . . . . 375.52 110.456 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -89.82 119.61 69.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.948 -0.569 . . . . 999.99 110.217 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.99 137.76 82.54 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.537 2.158 . . . . 436.63 112.386 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -106.81 -67.1 0.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 999.99 111.601 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -105.43 4.27 30.5 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.024 0.379 . . . . 999.99 112.024 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.64 125.25 22.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.58 -0.282 . . . . 781.6 110.957 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -99.53 112.02 24.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.339 . . . . 216.75 110.632 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -61.89 -39.67 92.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.795 -0.639 . . . . 902.9 111.354 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.81 80.03 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.367 -0.379 . . . . 121.35 111.983 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -64.09 -36.06 82.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.414 -0.357 . . . . 265.05 110.123 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 79.2 mm-40 -64.87 -40.39 95.04 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.921 -0.581 . . . . 524.44 110.078 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.4 -47.65 92.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 115.654 -0.703 . . . . 214.56 111.631 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -40.67 97.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 61.91 111.049 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.763 HD22 ' HB3' ' A' ' 85' ' ' TYR . 60.1 tp -65.57 -41.74 92.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.903 -0.59 . . . . 321.59 111.615 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG12 ' A' ' 24' ' ' ILE . 57.1 mtmt -60.24 -38.64 84.06 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.589 -0.278 . . . . 491.97 111.488 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.4 t -63.39 -43.68 98.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.635 0.255 . . . . 179.68 110.349 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -65.7 -40.39 92.23 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.365 -0.38 . . . . 483.12 110.708 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -42.41 94.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.94 -0.573 . . . . 120.91 110.915 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 20' ' ' LYS . 26.9 mm -60.07 -42.79 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.069 -0.514 . . . . 324.41 111.328 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.29 -42.97 96.6 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 111.559 0.207 . . . . 76.38 111.559 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.98 -44.3 96.15 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.744 -0.741 . . . . 59.56 112.848 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -73.03 -20.41 61.0 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.77 0.285 . . . . 169.43 111.77 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -75.63 -39.54 57.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.041 -0.355 . . . . 145.09 110.041 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -63.95 -42.0 97.43 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.328 -0.619 . . . . 779.77 109.328 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.469 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -64.53 -39.78 97.1 Favored Glycine 0 CA--C 1.52 0.374 0 CA-C-N 115.551 -0.749 . . . . 72.33 112.282 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 66.5 tp -59.19 -46.3 88.78 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.181 0.437 . . . . 213.67 112.181 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -27.08 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 120.835 -0.346 . . . . 275.82 111.883 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -63.86 -40.71 97.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.826 0.346 . . . . 545.0 110.937 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 2.7 m-90 -78.4 -31.77 48.44 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.773 0.321 . . . . 999.99 111.184 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 91.7 mt -63.02 -39.81 95.88 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.2 -0.454 . . . . 205.93 111.681 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -71.04 -19.31 62.51 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.886 0.328 . . . . 557.46 111.886 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.3 t -85.84 -44.88 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.734 0.302 . . . . 284.57 111.767 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -100.46 9.62 42.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.758 0.313 . . . . 350.44 111.547 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.25 -19.63 70.53 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.127 -0.488 . . . . 199.7 114.199 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.552 ' HG3' HG23 ' A' ' 41' ' ' THR . 52.0 ptt85 -64.15 -34.42 78.02 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.177 0.488 . . . . 999.99 112.226 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.552 HG23 ' HG3' ' A' ' 40' ' ' ARG . 58.5 p -114.05 -0.13 14.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.855 0.359 . . . . 302.8 111.79 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -72.31 124.95 26.17 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 581.97 111.836 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.9 m -77.82 158.91 29.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 239.07 110.705 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -60.67 -43.35 97.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.871 0.367 . . . . 192.01 111.203 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.604 HG13 ' HB2' ' A' ' 114' ' ' TYR . 67.3 t -66.62 -41.65 88.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.096 -0.502 . . . . 278.45 110.824 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 97.1 mt-30 -62.95 -39.54 94.96 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.967 -0.56 . . . . 316.42 111.511 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.05 -47.32 86.37 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.627 0.251 . . . . 470.35 111.105 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -65.21 -39.55 92.94 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.848 0.356 . . . . 369.78 110.858 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.92 86.55 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.838 -0.619 . . . . 66.79 111.363 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.0 mt -61.31 -36.42 80.06 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.042 -0.527 . . . . 238.3 112.244 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -59.54 -41.17 89.45 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.676 -0.49 . . . . 526.93 109.676 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -67.26 -41.44 85.54 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.864 -0.607 . . . . 162.88 110.039 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.79 -42.94 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.97 -0.559 . . . . 139.01 110.502 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -60.07 -42.78 95.29 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.078 -0.51 . . . . 198.61 110.539 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -63.32 -42.67 99.0 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.328 -0.396 . . . . 999.99 110.567 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -63.95 -43.08 96.88 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.138 0.494 . . . . 799.65 110.242 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -60.32 -47.35 86.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.335 -0.848 . . . . 151.58 110.51 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttp -60.0 -44.16 94.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.666 -0.697 . . . . 168.43 110.851 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.62 -41.51 99.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.113 -0.494 . . . . 530.56 110.976 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.0 m -62.5 -47.06 85.6 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.287 -0.415 . . . . 293.49 111.231 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -64.37 -47.07 80.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.041 -0.527 . . . . 383.72 110.75 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -62.82 -47.73 82.14 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.345 0.498 . . . . 497.0 112.345 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.79 78.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.784 0.661 . . . . 177.0 112.784 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.99 -50.36 74.38 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 121.223 -0.191 . . . . 478.76 111.341 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -73.02 -41.06 64.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.731 0.3 . . . . 727.09 111.209 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.4 tmm? -54.71 -47.32 73.87 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.709 -0.678 . . . . 664.46 112.327 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.3 mt -61.35 -41.09 96.49 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 111.928 0.344 . . . . 447.74 111.928 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -62.51 -47.9 81.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 999.99 111.494 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.6 tt -78.47 -32.19 16.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.621 0.6 . . . . 398.95 112.621 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -60.95 -41.5 96.42 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.63 0.252 . . . . 366.97 111.225 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -60.68 -45.98 92.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 709.01 110.254 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.17 -43.03 93.02 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.907 -0.588 . . . . 931.14 111.474 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.34 -46.36 95.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-O 120.785 0.326 . . . . 175.26 111.394 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.45 -45.1 94.62 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.168 -0.469 . . . . 443.19 111.27 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.3 95.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.438 -0.346 . . . . 366.44 111.81 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.48 -38.48 81.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.557 -0.292 . . . . 386.93 111.502 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.22 6.92 70.64 Favored Glycine 0 CA--C 1.518 0.259 0 C-N-CA 120.772 -0.728 . . . . 244.67 112.465 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -74.04 151.23 40.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.846 0.355 . . . . 999.99 110.981 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.7 p -114.91 95.08 40.4 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 263.29 111.238 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -72.31 155.79 55.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.731 2.287 . . . . 173.89 112.66 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.5 m -100.3 175.49 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 201.66 111.445 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.0 t -60.19 -40.88 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.147 -0.479 . . . . 81.09 111.193 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.4 -39.69 95.13 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.842 -0.694 . . . . 106.63 112.475 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.31 -40.18 95.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.022 0.439 . . . . 397.23 110.347 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.763 ' HB3' HD22 ' A' ' 19' ' ' LEU . 42.8 m-85 -68.47 -39.19 81.48 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.68 -0.691 . . . . 176.41 111.838 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.9 p -66.42 -29.66 69.85 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.835 0.309 . . . . 224.32 111.835 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -63.57 -42.14 98.35 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.01 0.433 . . . . 999.99 110.056 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.26 -41.0 74.05 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.812 -0.631 . . . . 158.17 110.493 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.09 -40.4 99.17 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.417 -0.811 . . . . 65.71 112.95 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.44 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.57 -41.97 98.16 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.432 0.158 . . . . 95.38 111.301 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.93 -41.86 97.51 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.936 0.398 . . . . 381.14 110.55 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 92.8 mt -65.27 -42.9 95.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.768 -0.651 . . . . 182.12 110.912 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.32 -20.92 65.88 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 116.019 -0.537 . . . . 88.8 113.544 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 95.7 mtt-85 -79.44 -17.54 54.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.916 0.358 . . . . 999.99 111.42 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -108.71 110.93 22.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.885 0.374 . . . . 999.99 110.88 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.8 mt -129.39 125.55 62.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.831 -0.433 . . . . 308.67 109.831 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -122.46 51.56 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.976 0.417 . . . . 388.05 110.999 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.4 ptm -91.96 -9.73 41.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.123 -0.49 . . . . 360.57 111.837 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.47 95.91 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.837 0.351 . . . . 184.23 111.753 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -70.06 -28.24 65.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.465 . . . . 999.99 111.247 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -58.2 -46.57 85.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.339 -0.391 . . . . 374.13 111.217 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.608 0.242 . . . . 999.99 111.11 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.5 -45.3 69.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.349 -0.387 . . . . 558.87 110.908 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.17 96.07 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.98 -0.554 . . . . 332.85 111.816 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.38 -47.89 84.13 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.421 -0.354 . . . . 472.21 110.83 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -64.27 -40.25 95.61 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.272 -0.422 . . . . 821.44 111.102 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.09 -39.05 80.99 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.001 -0.545 . . . . 746.24 112.16 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -83.0 -11.94 57.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 111.66 0.244 . . . . 999.99 111.66 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.8 t30 52.56 48.64 22.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.027 0.441 . . . . 675.44 111.391 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 19.2 mmt -122.98 102.67 8.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.369 -0.378 . . . . 999.99 110.84 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.2 mt -93.93 117.57 67.21 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.492 -0.322 . . . . 390.38 110.326 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.36 149.48 50.78 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.439 2.093 . . . . 243.11 112.846 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -84.59 147.16 27.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 618.1 110.227 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.604 ' HB2' HG13 ' A' ' 45' ' ' VAL . 76.5 t80 -66.77 123.04 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 999.99 110.689 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 85.6 mt -98.89 120.73 57.97 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.083 -0.508 . . . . 415.25 111.447 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.67 -28.45 81.62 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.025 2.484 . . . . 529.15 112.37 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.49 -29.0 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.704 -0.68 . . . . 516.88 111.709 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 66.6 mtt -60.01 -39.21 85.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.568 -0.287 . . . . 914.6 110.758 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.41 -40.72 95.42 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.176 -0.465 . . . . 675.31 110.936 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -62.12 -44.38 96.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.174 -0.466 . . . . 900.95 110.966 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.51 -45.09 99.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.353 -0.385 . . . . 300.73 111.11 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -63.09 -40.89 98.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.251 -0.431 . . . . 595.29 112.007 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -66.35 -33.71 76.33 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.383 0.512 . . . . 999.99 112.383 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.8 mtm -80.25 136.98 36.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.789 0.328 . . . . 385.68 111.665 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.496 ' O ' HG23 ' A' ' 129' ' ' VAL . 77.3 mtp85 -53.4 144.12 32.9 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 115.815 -0.63 . . . . 999.99 111.165 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -52.89 -33.95 63.89 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.233 2.622 . . . . 149.6 113.061 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.79 -36.37 78.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 147.02 111.809 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.45 -0.51 57.63 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.972 0.36 . . . . 360.37 111.972 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.9 t -91.7 114.61 62.48 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.705 0.288 . . . . 187.93 111.022 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.04 157.9 50.3 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.653 2.235 . . . . 265.39 112.352 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 m -120.61 155.89 23.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.299 -0.41 . . . . 246.78 110.761 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -98.26 119.59 37.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.025 0.441 . . . . 999.99 111.381 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -84.37 155.69 22.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.767 -0.651 . . . . 495.41 109.911 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.261 -0.876 . . . . 761.34 111.051 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.2 t . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.903 0.382 . . . . 375.52 110.413 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.99 156.07 72.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.424 . . . . 999.99 110.986 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.32 151.37 65.84 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.464 2.109 . . . . 436.63 112.323 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.52 ' HG3' ' CD1' ' A' ' 10' ' ' PHE . 22.5 tptm -104.0 123.57 47.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 999.99 110.305 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.52 ' CD1' ' HG3' ' A' ' 9' ' ' LYS . 75.3 m-85 59.01 39.4 23.53 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.575 0.547 . . . . 999.99 111.683 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -56.99 120.02 7.26 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.869 0.366 . . . . 781.6 111.278 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -114.3 123.35 49.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.322 -0.399 . . . . 216.75 110.154 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -61.87 -39.48 92.06 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.399 -0.364 . . . . 902.9 111.213 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.75 -38.41 81.66 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.144 -0.48 . . . . 121.35 111.616 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -71.25 -25.48 62.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 265.05 111.438 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.08 -40.11 96.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.276 -0.42 . . . . 524.44 112.115 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -72.82 -27.19 24.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 120.782 -0.367 . . . . 214.56 111.633 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.87 93.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.326 0.584 . . . . 61.91 109.631 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.405 HD13 ' CZ2' ' A' ' 62' ' ' TRP . 56.8 mt -64.08 -41.16 97.41 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.123 -0.944 . . . . 321.59 111.206 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.41 -40.15 93.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.992 -0.549 . . . . 491.97 111.788 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.6 t -64.51 -45.95 94.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.582 -0.281 . . . . 179.68 111.51 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.86 -41.15 75.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.958 0.355 . . . . 483.12 111.958 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.403 ' O ' ' HD1' ' A' ' 27' ' ' PHE . 96.7 mt -66.95 -44.8 88.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.404 -0.362 . . . . 120.91 111.933 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.2 tt -63.18 -32.74 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 111.964 0.357 . . . . 324.41 111.964 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.66 -45.95 92.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.407 -0.36 . . . . 76.38 111.457 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.18 -41.94 91.73 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.753 -0.737 . . . . 59.56 112.617 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 43.8 m-85 -70.27 -28.05 64.91 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.74 0.274 . . . . 169.43 111.74 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -40.99 46.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.436 -0.209 . . . . 145.09 110.436 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -62.85 -44.56 95.81 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.622 -0.51 . . . . 779.77 109.622 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -38.64 96.65 Favored Glycine 0 C--N 1.335 0.489 0 CA-C-N 115.464 -0.789 . . . . 72.33 112.226 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 tp -64.09 -42.96 96.73 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.736 0.303 . . . . 213.67 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.51 -45.26 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.983 -0.553 . . . . 275.82 110.598 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -62.5 -40.59 97.2 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.838 0.351 . . . . 545.0 110.473 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -63.13 -43.95 96.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.995 -0.548 . . . . 999.99 110.033 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' HG3' ' A' ' 47' ' ' LYS . 85.8 mt -62.46 -37.93 87.85 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.698 -0.683 . . . . 205.93 111.214 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.71 -37.74 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.688 0.28 . . . . 557.46 111.579 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.6 t -87.33 -50.66 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 113.525 0.935 . . . . 284.57 113.525 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.9 m80 -101.9 -27.56 12.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.022 0.749 . . . . 350.44 113.022 -177.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.566 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -72.08 -11.7 75.0 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.07 -0.586 . . . . 199.7 113.401 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -60.85 -39.92 90.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.819 0.303 . . . . 999.99 111.819 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 76.6 p -97.85 -8.13 28.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.246 0.461 . . . . 302.8 112.246 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.566 HD12 ' HA2' ' A' ' 39' ' ' GLY . 97.2 mt -73.11 150.7 42.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.064 0.459 . . . . 581.97 111.819 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 m -72.72 161.86 30.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.753 -0.658 . . . . 239.07 110.642 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -59.48 -40.1 85.86 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.109 -0.496 . . . . 192.01 111.12 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HB2' ' A' ' 114' ' ' TYR . 55.8 t -65.15 -43.46 95.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.415 . . . . 278.45 110.852 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.88 -39.96 94.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.269 -0.423 . . . . 316.42 111.054 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG3' HD22 ' A' ' 35' ' ' LEU . 87.8 tttt -61.32 -47.18 87.13 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.277 -0.419 . . . . 470.35 110.795 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.41 -38.61 90.46 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.277 -0.419 . . . . 369.78 111.399 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.53 86.07 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.126 -0.488 . . . . 66.79 111.608 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -60.11 -30.67 69.42 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.171 -0.468 . . . . 238.3 111.99 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -62.35 -41.2 98.4 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.631 0.253 . . . . 526.93 110.769 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -66.58 -41.01 89.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.112 0.482 . . . . 162.88 110.122 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.481 HG22 HH21 ' A' ' 56' ' ' ARG . 62.6 t -60.86 -41.31 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 115.418 -0.81 . . . . 139.01 110.502 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.79 -42.15 88.35 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.928 -0.578 . . . . 198.61 110.506 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -63.28 -44.57 94.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.511 -0.313 . . . . 999.99 110.975 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.481 HH21 HG22 ' A' ' 53' ' ' VAL . 80.7 mtm180 -65.27 -42.41 93.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.989 0.423 . . . . 799.65 111.168 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -62.05 -44.43 96.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.535 -0.757 . . . . 151.58 110.499 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 9.0 ttp -59.4 -40.88 88.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.864 -0.607 . . . . 168.43 110.744 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.19 -42.54 99.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.169 -0.469 . . . . 530.56 111.365 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 134' ' ' MET . 75.4 p -71.39 -37.87 71.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.806 0.336 . . . . 293.49 111.116 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -63.99 -44.86 91.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.034 -0.53 . . . . 383.72 109.683 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.405 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 38.6 t-105 -61.74 -45.47 93.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.367 -0.833 . . . . 497.0 111.918 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.41 77.99 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.511 0.56 . . . . 177.0 112.511 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -62.13 -41.49 98.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.722 0.267 . . . . 478.76 111.722 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -82.52 -33.73 28.15 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.623 -0.262 . . . . 727.09 111.527 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.2 ttp -53.17 -43.93 67.46 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.988 -0.551 . . . . 664.46 112.02 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 98.1 mt -60.87 -41.41 95.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.295 -0.411 . . . . 447.74 111.339 -178.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -69.03 -39.74 79.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.473 -0.331 . . . . 999.99 111.299 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.95 -45.34 99.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.038 -0.528 . . . . 398.95 111.349 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -62.33 -37.13 84.45 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.235 -0.439 . . . . 366.97 112.103 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -60.89 -42.89 98.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.631 0.253 . . . . 709.01 110.931 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -67.41 -42.46 83.23 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.358 -0.383 . . . . 931.14 111.419 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.93 -47.04 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.307 -0.406 . . . . 175.26 111.168 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -63.05 -43.95 97.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.161 -0.472 . . . . 443.19 111.452 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.47 -40.77 98.0 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.471 -0.331 . . . . 366.44 111.859 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.1 mt -70.26 -41.34 73.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.953 0.406 . . . . 386.93 111.278 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.52 -10.61 71.13 Favored Glycine 0 CA--C 1.52 0.36 0 CA-C-N 116.05 -0.523 . . . . 244.67 112.779 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.5 mpt_? -75.22 149.25 38.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.672 0.273 . . . . 999.99 111.347 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 74.9 p -72.24 138.48 81.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.387 -0.37 . . . . 263.29 110.585 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.0 136.99 23.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.291 1.994 . . . . 173.89 112.748 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 84' ' ' ASP . 14.7 m -104.37 155.14 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.243 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 79.6 t -63.58 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.17 -0.468 . . . . 81.09 111.169 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.63 97.7 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.745 -0.741 . . . . 106.63 112.608 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.522 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.2 t70 -64.38 -41.14 96.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.156 0.503 . . . . 397.23 109.807 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -63.0 -42.41 99.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.316 -0.856 . . . . 176.41 111.324 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -67.74 -36.2 80.13 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.9 -0.32 . . . . 224.32 110.932 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -62.83 -46.48 87.75 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.003 0.43 . . . . 999.99 110.01 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.27 -41.23 94.42 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.747 -0.661 . . . . 158.17 110.792 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.06 -41.07 99.67 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-N 115.97 -0.559 . . . . 65.71 112.413 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -62.26 -40.13 95.19 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.605 0.24 . . . . 95.38 110.95 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -66.98 -40.8 87.49 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.063 0.459 . . . . 381.14 110.467 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.5 mt -64.71 -41.5 92.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.562 -0.745 . . . . 182.12 111.031 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.09 -11.77 59.25 Favored Glycine 0 CA--C 1.52 0.384 0 CA-C-N 115.969 -0.559 . . . . 88.8 113.694 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 79.5 mtp85 -80.19 -10.96 59.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.069 0.434 . . . . 999.99 111.239 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.2 mmt85 -108.42 129.3 55.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.924 0.392 . . . . 999.99 110.925 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.83 -76.87 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.438 . . . . 308.67 111.093 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.1 t0 55.79 49.01 17.01 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.999 0.428 . . . . 388.05 111.649 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.6 mtm -86.52 -2.34 58.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.244 -0.435 . . . . 360.57 111.531 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.15 89.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.172 -0.467 . . . . 184.23 111.919 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -62.89 -39.02 93.2 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.257 -0.429 . . . . 999.99 111.868 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.485 ' CE2' HD11 ' A' ' 105' ' ' LEU . 86.7 t80 -58.97 -47.19 86.01 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.821 0.343 . . . . 374.13 110.736 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -59.75 -47.68 84.69 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.002 -0.544 . . . . 999.99 110.733 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.42 -39.21 89.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.039 -0.528 . . . . 558.87 110.931 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.41 95.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.152 -0.476 . . . . 332.85 111.317 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.485 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.24 -43.02 99.78 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.606 -0.27 . . . . 472.21 110.692 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.7 -44.39 93.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.226 -0.443 . . . . 821.44 110.721 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.45 -43.26 88.75 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.777 -0.647 . . . . 746.24 111.769 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -87.91 -5.16 58.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.385 -0.371 . . . . 999.99 111.647 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.16 43.68 26.37 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.935 0.494 . . . . 675.44 111.187 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.1 103.75 13.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.318 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -94.59 117.81 66.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.007 -0.542 . . . . 390.38 110.334 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.43 138.68 33.15 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.29 1.993 . . . . 243.11 112.887 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -86.27 144.27 27.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.935 -0.575 . . . . 618.1 110.957 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.607 ' HB2' HG13 ' A' ' 45' ' ' VAL . 47.0 t80 -68.95 99.17 1.03 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.728 0.299 . . . . 999.99 111.214 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.9 mt -98.74 123.34 50.06 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.419 -0.355 . . . . 415.25 110.975 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.81 -34.27 84.43 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.165 2.576 . . . . 529.15 112.479 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.98 -43.87 94.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.901 -0.59 . . . . 516.88 111.334 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.77 -41.14 90.4 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.474 -0.33 . . . . 914.6 110.535 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -61.77 -42.1 98.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.958 -0.565 . . . . 675.31 110.327 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.48 -43.42 98.86 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.003 -0.544 . . . . 900.95 111.452 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.578 HG23 HG21 ' A' ' 129' ' ' VAL . 34.6 mm -61.91 -46.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.76 0.314 . . . . 300.73 111.001 178.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -62.5 -40.8 97.89 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.098 -0.501 . . . . 595.29 111.378 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 67.4 ttp85 -64.86 -34.84 79.32 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.188 -0.46 . . . . 999.99 111.826 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.9 mtp -72.89 134.49 44.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.949 0.404 . . . . 385.68 111.753 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -53.85 145.05 33.57 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.517 -0.765 . . . . 999.99 111.3 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.57 -38.5 83.88 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.969 2.446 . . . . 149.6 112.942 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.45 75.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.572 . . . . 147.02 112.114 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -90.03 -15.0 32.71 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.205 0.817 . . . . 360.37 113.205 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.578 HG21 HG23 ' A' ' 121' ' ' ILE . 9.0 p -105.03 130.95 22.26 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 120.501 -0.479 . . . . 187.93 111.441 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -61.3 147.24 96.08 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.816 2.344 . . . . 265.39 112.491 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.2 m -126.3 152.31 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.211 -0.45 . . . . 246.78 110.394 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -118.84 127.7 53.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 999.99 110.992 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -84.49 80.54 9.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.037 -0.529 . . . . 495.41 110.478 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.605 ' HB2' HG22 ' A' ' 60' ' ' THR . 97.6 mtp . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.1 -0.953 . . . . 761.34 111.106 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.4 t . . . . . 0 C--O 1.232 0.179 0 N-CA-C 109.83 -0.433 . . . . 375.52 109.83 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.07 149.18 65.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 110.411 -0.218 . . . . 999.99 110.411 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.82 136.04 37.34 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.085 1.857 . . . . 436.63 112.367 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -120.63 -38.81 2.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.586 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -103.1 2.39 34.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.791 0.293 . . . . 999.99 111.791 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.1 tp -57.91 124.12 18.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.754 0.312 . . . . 781.6 110.743 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -113.26 120.1 40.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 216.75 110.495 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -62.1 -37.95 87.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 902.9 111.068 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.24 82.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.191 -0.458 . . . . 121.35 111.587 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -77.74 -20.39 53.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 265.05 110.976 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.39 -42.56 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 524.44 111.612 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.02 -32.55 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 120.961 -0.296 . . . . 214.56 111.685 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.57 -44.32 96.63 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.114 0.483 . . . . 61.91 110.252 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HB3' ' A' ' 85' ' ' TYR . 90.9 mt -69.51 -38.2 77.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.475 -0.784 . . . . 321.59 111.329 178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -59.03 -41.92 88.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.548 -0.751 . . . . 491.97 111.794 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.01 -44.69 99.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.527 0.204 . . . . 179.68 111.116 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.88 -40.78 91.92 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.82 0.343 . . . . 483.12 111.148 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.72 -42.78 95.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.913 -0.585 . . . . 120.91 111.503 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 86.8 mt -60.21 -42.5 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.391 -0.368 . . . . 324.41 111.621 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.87 94.89 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.079 -0.248 . . . . 76.38 111.42 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -66.61 -40.69 94.16 Favored Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.876 -0.678 . . . . 59.56 112.578 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -73.12 -18.34 61.3 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 122.762 0.425 . . . . 169.43 112.009 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.04 -38.96 61.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.787 0.291 . . . . 145.09 111.787 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 26' ' ' GLY . 16.7 ptm180 -66.19 -32.3 73.65 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 120.516 -0.474 . . . . 779.77 110.11 179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.96 -39.16 97.72 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 115.683 -0.69 . . . . 72.33 112.138 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 54' ' ' ASN . 84.2 mt -63.77 -39.28 93.87 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.55 0.214 . . . . 213.67 110.876 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.496 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 69.6 t -61.03 -46.73 96.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.16 -0.473 . . . . 275.82 111.095 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -64.23 -41.5 96.97 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.908 0.385 . . . . 545.0 110.979 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.56 ' O ' HG12 ' A' ' 37' ' ' VAL . 76.5 t90 -65.46 -43.33 90.7 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.404 0.621 . . . . 999.99 110.39 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 42' ' ' LEU . 48.0 tp -61.46 -33.19 73.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.187 -0.915 . . . . 205.93 112.487 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 32' ' ' VAL . 99.4 mtt180 -58.24 -28.49 64.95 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.38 0.881 . . . . 557.46 113.38 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 34' ' ' TRP . 8.6 p -84.5 -26.33 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.667 -0.413 . . . . 284.57 112.022 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -111.2 15.28 21.58 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.65 0.262 . . . . 350.44 111.257 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -39.81 97.81 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.066 -0.515 . . . . 199.7 114.293 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.53 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -65.12 -23.23 67.08 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.606 0.595 . . . . 999.99 112.606 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.53 HG23 ' HG3' ' A' ' 40' ' ' ARG . 44.6 p -112.83 11.65 19.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.046 0.387 . . . . 302.8 112.046 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 35' ' ' LEU . 56.6 tp -71.9 122.49 20.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 581.97 112.041 -179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 71.1 m -80.53 159.21 25.58 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.963 -0.562 . . . . 239.07 110.033 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -61.73 -43.77 98.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.659 0.266 . . . . 192.01 111.639 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -73.22 -31.22 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 111.7 0.259 . . . . 278.45 111.7 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -62.8 -38.54 91.09 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.784 0.29 . . . . 316.42 111.784 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -59.77 -46.26 89.74 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.732 0.301 . . . . 470.35 110.388 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.42 -39.0 91.6 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.221 -0.445 . . . . 369.78 110.396 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.53 -36.54 80.84 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.549 -0.75 . . . . 66.79 111.849 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.21 -36.68 78.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.372 -0.376 . . . . 238.3 111.904 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -61.22 -39.61 90.9 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.471 -0.566 . . . . 526.93 109.471 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.72 -39.84 88.18 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.757 -0.656 . . . . 162.88 109.776 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 63.2 t -60.11 -39.15 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.142 0 CA-C-N 115.741 -0.663 . . . . 139.01 110.461 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.583 ' HB2' HD11 ' A' ' 31' ' ' LEU . 13.5 t30 -56.88 -47.05 81.37 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.327 -0.397 . . . . 198.61 110.799 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.97 -40.56 91.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.664 -0.244 . . . . 999.99 110.756 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -62.07 -45.49 93.28 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.056 0.455 . . . . 799.65 110.111 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -60.44 -47.04 87.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.571 -0.74 . . . . 151.58 110.157 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -46.9 88.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 168.43 111.474 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.499 ' HG2' HG23 ' A' ' 131' ' ' VAL . 77.5 mt-30 -62.85 -43.44 98.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.005 0.372 . . . . 530.56 112.005 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.3 p -71.57 -40.42 69.95 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.797 0.295 . . . . 293.49 111.797 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.435 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 61.1 t-80 -64.13 -47.56 79.47 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.875 0.369 . . . . 383.72 110.548 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -63.74 -44.15 94.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.747 -0.661 . . . . 497.0 112.081 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.64 83.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.796 0.665 . . . . 177.0 112.796 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -64.62 -40.89 96.29 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.921 0.341 . . . . 478.76 111.921 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 79.8 m-85 -81.49 -26.78 34.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.757 0.28 . . . . 727.09 111.757 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.5 ttp -52.54 -41.6 63.67 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.051 -0.522 . . . . 664.46 112.072 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.78 -44.61 90.7 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.663 -0.244 . . . . 447.74 111.494 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.6 m0 -67.36 -41.15 85.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 999.99 110.818 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 47.5 mm -67.37 -45.41 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 115.95 -0.568 . . . . 398.95 111.047 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.16 -41.93 97.65 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.949 -0.569 . . . . 366.97 111.47 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -60.18 -45.55 92.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.435 -0.348 . . . . 709.01 110.63 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.62 -42.66 95.36 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.402 -0.363 . . . . 931.14 111.269 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -63.8 -46.92 93.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.813 0.34 . . . . 175.26 111.164 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.43 -40.81 97.77 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.257 -0.429 . . . . 443.19 111.312 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.46 95.92 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.374 -0.375 . . . . 366.44 111.419 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.1 mt -69.77 -40.47 76.05 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.341 -0.39 . . . . 386.93 111.341 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 -8.22 79.59 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.044 -0.598 . . . . 244.67 112.507 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -74.76 153.06 38.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 999.99 111.707 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -108.53 95.96 17.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.008 -0.542 . . . . 263.29 110.651 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.89 147.61 55.96 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.552 2.168 . . . . 173.89 113.282 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -101.07 -175.37 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.615 -0.721 . . . . 201.66 111.142 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.3 t -58.77 -41.97 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.404 -0.362 . . . . 81.09 110.718 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.615 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.57 -40.62 98.1 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.658 -0.782 . . . . 106.63 112.181 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.15 -40.58 90.7 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 397.23 110.692 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.52 ' HB3' HD11 ' A' ' 19' ' ' LEU . 33.3 m-85 -69.18 -36.26 77.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.705 -0.68 . . . . 176.41 112.174 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.615 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.8 OUTLIER -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.638 0.236 . . . . 224.32 111.638 -179.089 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.21 -46.34 89.35 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.722 -0.473 . . . . 999.99 109.722 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.71 -39.82 84.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.582 -0.735 . . . . 158.17 110.423 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.66 99.2 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 115.717 -0.674 . . . . 65.71 112.436 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.77 -41.22 97.42 Favored 'General case' 0 C--N 1.335 -0.064 0 CA-C-O 120.745 0.307 . . . . 95.38 110.498 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.48 -40.06 95.46 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.039 -0.528 . . . . 381.14 110.596 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 37.4 mm -63.28 -43.65 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.948 -0.569 . . . . 182.12 110.383 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 -20.61 66.84 Favored Glycine 0 CA--C 1.521 0.457 0 CA-C-N 115.873 -0.603 . . . . 88.8 113.609 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 42.0 mmt180 -79.73 -16.12 56.22 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.939 0.369 . . . . 999.99 111.384 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 -107.7 111.72 24.06 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.015 -0.365 . . . . 999.99 110.015 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -125.44 125.33 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.412 -0.358 . . . . 308.67 110.164 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.6 70.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.986 0.422 . . . . 388.05 110.888 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.82 -29.01 66.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.885 -0.598 . . . . 360.57 110.764 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.03 79.88 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.532 -0.758 . . . . 184.23 111.405 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.44 -46.98 85.45 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.113 -0.494 . . . . 999.99 111.064 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.27 -48.17 81.29 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.781 0.324 . . . . 374.13 110.728 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.69 -47.96 83.92 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.995 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -62.2 -39.08 91.55 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.055 -0.52 . . . . 558.87 111.609 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.47 94.57 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.384 -0.371 . . . . 332.85 111.265 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 90.2 mt -63.33 -40.83 98.37 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.304 -0.407 . . . . 472.21 110.667 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -64.7 -40.18 94.93 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.008 -0.542 . . . . 821.44 110.903 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.32 -43.36 88.16 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.882 -0.599 . . . . 746.24 111.525 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt -87.19 -6.92 58.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.472 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 56.42 37.24 28.65 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.956 0.502 . . . . 675.44 111.334 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.8 ttp -116.89 117.37 29.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 999.99 111.311 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.75 119.54 65.96 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.051 -0.522 . . . . 390.38 110.224 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.07 138.87 87.91 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.515 2.143 . . . . 243.11 112.33 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -85.49 119.52 25.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.414 -0.357 . . . . 618.1 110.966 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -70.01 89.84 0.62 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.068 -0.514 . . . . 999.99 110.562 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 86.4 mt -97.8 141.93 23.76 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 112.006 0.372 . . . . 415.25 112.006 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.4 Cg_exo -58.6 -33.04 97.88 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.237 2.625 . . . . 529.15 112.575 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -59.72 -44.54 93.68 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.077 -0.51 . . . . 516.88 111.203 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 65.6 mtt -60.51 -40.2 90.55 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.798 -0.445 . . . . 914.6 109.798 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.94 -40.57 96.0 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.619 -0.718 . . . . 675.31 110.444 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.14 -39.79 94.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.694 -0.685 . . . . 900.95 111.072 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.3 mt -61.09 -43.64 96.67 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.434 -0.348 . . . . 300.73 110.73 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.77 -37.78 83.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.258 -0.428 . . . . 595.29 110.336 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -64.11 -33.39 75.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.64 . . . . 999.99 110.758 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 69.6 mtm -68.47 140.0 55.72 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.462 -0.335 . . . . 385.68 110.956 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.472 ' O ' HG23 ' A' ' 129' ' ' VAL . 55.6 mmm-85 -52.46 137.48 41.09 Favored Pre-proline 0 N--CA 1.465 0.302 0 CA-C-N 115.892 -0.595 . . . . 999.99 111.51 178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -35.13 79.01 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.316 2.677 . . . . 149.6 113.229 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.1 77.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 147.02 112.106 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.75 -1.98 57.83 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.87 0.322 . . . . 360.37 111.87 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 125' ' ' ARG . 68.7 t -98.59 115.75 65.66 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.679 0.276 . . . . 187.93 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.57 156.09 61.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.671 2.247 . . . . 265.39 112.473 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.499 HG23 ' HG2' ' A' ' 59' ' ' GLN . 3.5 p -106.89 139.78 27.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 246.78 110.448 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -107.87 131.88 54.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.057 0.456 . . . . 999.99 110.879 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -83.95 156.71 22.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.848 -0.614 . . . . 495.41 110.733 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.2 mmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.425 -0.798 . . . . 761.34 111.045 -179.6 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 C--O 1.233 0.236 0 N-CA-C 110.234 -0.284 . . . . 375.52 110.234 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.05 149.82 70.61 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.881 0.372 . . . . 999.99 111.376 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.25 161.21 45.15 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.052 2.501 . . . . 436.63 113.076 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.0 mttp 67.42 17.32 10.1 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.428 -0.805 . . . . 999.99 112.258 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -62.28 -50.09 73.08 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.079 0.466 . . . . 999.99 110.378 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.06 139.84 56.43 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.411 -0.813 . . . . 781.6 111.245 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -61.69 129.83 42.95 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.396 -0.365 . . . . 216.75 110.293 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -63.24 -20.34 65.36 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.556 0.576 . . . . 902.9 112.556 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.3 -39.09 81.91 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.75 0.309 . . . . 121.35 111.632 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -68.37 -30.45 69.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 265.05 110.885 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.25 -39.68 94.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 524.44 110.76 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.6 -48.98 86.26 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-N 116.148 -0.478 . . . . 214.56 111.386 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.25 -41.69 99.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.023 -0.535 . . . . 61.91 111.433 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 85' ' ' TYR . 51.6 tp -66.5 -41.42 88.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 321.59 111.392 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -59.28 -35.24 73.4 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.952 -0.567 . . . . 491.97 112.054 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.17 -44.15 98.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.822 0.344 . . . . 179.68 110.291 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -69.97 -38.57 76.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.961 0.41 . . . . 483.12 110.465 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.8 mt -61.05 -47.09 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.765 0.654 . . . . 120.91 112.765 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 32.9 pt -60.26 -36.22 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 112.775 0.657 . . . . 324.41 112.775 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.91 -46.22 90.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.665 0.269 . . . . 76.38 111.361 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.67 -41.14 89.95 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 121.138 -0.554 . . . . 59.56 112.888 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -73.62 -21.09 60.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.268 . . . . 169.43 111.704 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 32' ' ' VAL . 16.3 t70 -77.12 -40.23 46.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.684 -0.235 . . . . 145.09 110.705 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.07 -42.38 99.65 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.001 0.429 . . . . 779.77 109.954 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -65.48 -39.59 95.74 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.639 -0.709 . . . . 72.33 111.773 178.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.9 -41.62 98.12 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 115.64 -0.28 . . . . 213.67 110.768 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 28' ' ' ASP . 64.4 t -60.72 -42.77 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.18 -0.464 . . . . 275.82 111.115 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -61.39 -41.56 97.32 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.608 -0.269 . . . . 545.0 111.21 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.558 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 1.8 m-90 -74.24 -37.3 63.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.036 0.446 . . . . 999.99 110.94 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.3 tp -64.31 -41.85 96.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.945 -0.571 . . . . 205.93 112.039 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -66.18 -23.0 66.38 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.192 0.812 . . . . 557.46 113.192 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.1 m -98.21 -20.0 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 112.991 0.737 . . . . 284.57 112.991 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -109.35 -27.41 9.52 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.879 -0.328 . . . . 350.44 111.666 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.95 -26.33 60.65 Favored Glycine 0 C--N 1.331 0.265 0 CA-C-N 115.801 -0.636 . . . . 199.7 114.38 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.56 ' HG3' HG23 ' A' ' 41' ' ' THR . 12.3 ptp85 -66.4 -22.49 66.23 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.558 0.679 . . . . 999.99 111.36 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 40' ' ' ARG . 66.1 p -112.55 -20.67 11.65 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.234 0.457 . . . . 302.8 112.234 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.1 mt -73.09 147.32 45.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.122 0.487 . . . . 581.97 112.093 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -75.97 163.62 26.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 239.07 109.75 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.3 m -58.88 -42.31 89.2 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.826 0.346 . . . . 192.01 110.893 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.55 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.2 t -66.09 -42.23 91.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.311 -0.404 . . . . 278.45 110.581 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.25 -40.21 96.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.147 -0.479 . . . . 316.42 111.455 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.14 -41.99 99.39 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.661 0.267 . . . . 470.35 110.83 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.37 -39.25 85.65 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.005 0.431 . . . . 369.78 110.374 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 118' ' ' MET . . . -61.7 -36.16 80.1 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.556 -0.747 . . . . 66.79 111.105 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.78 -38.91 79.57 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.751 -0.659 . . . . 238.3 111.193 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -60.7 -40.52 92.52 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.836 0.35 . . . . 526.93 110.343 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -65.85 -40.65 91.91 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.92 -0.582 . . . . 162.88 109.968 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.82 -41.13 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 115.5 -0.773 . . . . 139.01 110.872 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -59.13 -42.73 91.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.312 -0.404 . . . . 198.61 110.598 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -65.03 -41.81 94.89 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.824 0.345 . . . . 999.99 110.519 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -63.41 -43.93 96.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.914 -0.585 . . . . 799.65 110.619 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -59.81 -48.34 82.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.704 -0.68 . . . . 151.58 111.039 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -61.16 -44.22 97.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.423 -0.353 . . . . 168.43 111.109 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.3 -43.21 99.34 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.113 0.412 . . . . 530.56 112.113 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.2 p -71.61 -41.16 69.26 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.959 -0.296 . . . . 293.49 111.571 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -63.22 -46.77 85.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.179 0.514 . . . . 383.72 110.179 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -63.83 -38.7 92.09 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.291 -0.868 . . . . 497.0 111.826 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.79 74.65 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.727 0.269 . . . . 177.0 111.727 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.87 -44.08 97.53 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.792 0.33 . . . . 478.76 110.302 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -70.6 -36.19 73.39 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.129 -0.487 . . . . 727.09 111.254 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 75.9 mmm -51.7 -35.22 41.93 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.065 -0.516 . . . . 664.46 112.261 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.29 -50.03 75.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.613 0.244 . . . . 447.74 111.168 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -69.45 -40.1 77.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.354 -0.385 . . . . 999.99 111.394 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.7 mm -64.78 -46.05 93.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.987 -0.551 . . . . 398.95 111.51 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.51 -43.09 99.67 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.368 -0.378 . . . . 366.97 111.23 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.59 -41.94 98.3 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.522 -0.308 . . . . 709.01 110.933 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.73 -47.1 85.02 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 931.14 110.83 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.69 -45.92 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.131 -0.486 . . . . 175.26 110.942 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.45 -45.1 94.58 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.227 -0.442 . . . . 443.19 111.684 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.66 98.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.654 -0.248 . . . . 366.44 111.594 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.4 tp -68.13 -45.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.152 0.501 . . . . 386.93 110.592 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.03 -23.02 31.27 Favored Glycine 0 C--N 1.331 0.278 0 CA-C-N 115.708 -0.678 . . . . 244.67 112.789 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -76.54 141.79 41.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.602 0.239 . . . . 999.99 110.932 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.3 p -82.0 134.41 49.71 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.579 -0.282 . . . . 263.29 110.702 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 154.95 46.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.66 2.24 . . . . 173.89 112.745 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.544 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.3 m -101.72 158.04 4.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.346 -0.388 . . . . 201.66 110.1 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.09 -45.0 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.391 -0.368 . . . . 81.09 111.97 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.459 ' O ' HG22 ' A' ' 86' ' ' THR . . . -61.26 -44.42 98.11 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.633 -0.794 . . . . 106.63 113.553 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.544 ' H ' HG23 ' A' ' 81' ' ' VAL . 33.5 t70 -71.22 -41.62 69.95 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.956 0.378 . . . . 397.23 111.491 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 19' ' ' LEU . 40.1 t80 -65.23 -39.68 93.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.094 -0.503 . . . . 176.41 111.582 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -60.46 -24.11 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.461 -0.336 . . . . 224.32 111.891 -179.604 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -62.41 -37.16 84.72 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.79 0.329 . . . . 999.99 110.887 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.67 -38.96 89.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.909 -0.587 . . . . 158.17 111.17 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.18 -39.3 96.97 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.916 -0.583 . . . . 65.71 113.101 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.09 98.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.633 0.254 . . . . 95.38 111.078 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.79 -40.09 95.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.116 -0.493 . . . . 381.14 110.85 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.5 mm -65.13 -42.71 95.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.772 -0.649 . . . . 182.12 110.953 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.54 -20.16 65.52 Favored Glycine 0 CA--C 1.52 0.388 0 CA-C-N 116.015 -0.539 . . . . 88.8 113.603 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -78.65 -24.52 45.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.037 0.418 . . . . 999.99 111.849 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.85 112.15 24.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 999.99 111.352 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.5 pt -134.69 153.47 35.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.325 -0.398 . . . . 308.67 110.757 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -147.17 55.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.053 0.454 . . . . 388.05 110.608 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.0 mtm -69.32 -28.81 66.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.78 -0.646 . . . . 360.57 111.711 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . 0.558 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -60.14 -40.16 88.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.286 -0.415 . . . . 184.23 111.717 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.15 -41.55 97.14 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.554 -0.293 . . . . 999.99 111.126 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -64.11 -43.89 93.94 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.697 -0.483 . . . . 374.13 109.697 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -60.11 -47.45 85.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.555 -0.748 . . . . 999.99 110.413 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -61.39 -40.51 94.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 558.87 110.694 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.04 96.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.094 -0.503 . . . . 332.85 111.37 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.92 -42.94 99.96 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.655 -0.248 . . . . 472.21 110.587 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -64.36 -42.99 95.92 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.029 -0.532 . . . . 821.44 110.932 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -57.97 -43.45 86.48 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.843 -0.617 . . . . 746.24 111.912 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -89.38 -4.91 57.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.547 -0.297 . . . . 999.99 111.47 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.5 t30 56.74 41.11 28.66 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.11 0.564 . . . . 675.44 111.226 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.3 mmm -108.04 101.76 10.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.342 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 76.1 mt -94.48 118.38 66.96 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.134 -0.485 . . . . 390.38 110.119 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.65 135.75 69.43 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.529 2.152 . . . . 243.11 112.754 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.49 143.37 28.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.202 -0.454 . . . . 618.1 110.673 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.55 ' HB2' HG13 ' A' ' 45' ' ' VAL . 27.8 t80 -68.86 108.05 3.31 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.903 0.382 . . . . 999.99 110.638 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.69 146.51 31.74 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.176 -0.465 . . . . 415.25 111.133 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -57.15 -38.38 95.61 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.886 2.391 . . . . 529.15 112.082 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -62.17 -39.43 92.67 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.64 -0.709 . . . . 516.88 110.871 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttm -58.34 -46.38 86.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.103 -0.499 . . . . 914.6 110.236 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.12 -43.67 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.448 . . . . 675.31 110.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 124' ' ' MET . 96.6 mt-10 -65.14 -42.08 94.16 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.111 0.782 . . . . 900.95 113.111 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.484 HG22 ' O ' ' A' ' 118' ' ' MET . 15.3 tt -64.64 -28.68 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 111.816 0.302 . . . . 300.73 111.816 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -63.48 -35.82 81.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.875 0.369 . . . . 595.29 111.005 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.54 -1.67 57.82 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.862 -0.608 . . . . 999.99 112.239 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 66.1 mtt -88.18 128.88 35.45 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.719 0.295 . . . . 385.68 111.573 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.529 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.5 mmt180 -53.51 142.52 40.57 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 115.939 -0.573 . . . . 999.99 110.758 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.46 -36.93 71.85 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.101 2.534 . . . . 149.6 113.283 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.17 -35.65 77.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 147.02 111.926 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -91.64 1.22 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.493 0.553 . . . . 360.37 112.493 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.4 t -90.34 113.02 55.97 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 187.93 110.965 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.67 157.25 40.04 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.812 2.341 . . . . 265.39 112.761 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.75 157.55 30.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.361 -0.381 . . . . 246.78 110.398 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -132.08 145.86 51.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.059 0.457 . . . . 999.99 111.326 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.89 168.05 15.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 495.41 111.031 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.167 -0.92 . . . . 761.34 110.949 179.945 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.65 0.262 . . . . 375.52 110.897 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.4 147.32 63.77 Favored Pre-proline 0 C--O 1.234 0.277 0 CA-C-N 116.39 -0.368 . . . . 999.99 110.55 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.82 148.35 40.91 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.763 2.308 . . . . 436.63 113.299 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -73.76 135.32 43.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.808 -0.633 . . . . 999.99 109.652 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -77.85 93.29 4.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.419 . . . . 999.99 110.793 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.68 142.41 45.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.522 -0.763 . . . . 781.6 111.831 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 64.6 t30 -66.47 132.58 48.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.784 -0.45 . . . . 216.75 109.784 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.07 -40.52 93.99 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.657 -0.247 . . . . 902.9 111.655 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.426 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -60.29 -39.82 88.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 121.35 111.521 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -73.21 -28.37 62.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.208 -0.451 . . . . 265.05 111.004 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 12' ' ' ASN . 96.4 mt-10 -63.88 -39.96 95.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.296 0.48 . . . . 524.44 112.296 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 14' ' ' ALA . 34.6 m -69.57 -34.1 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 120.674 -0.41 . . . . 214.56 111.491 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.94 95.05 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.248 0.547 . . . . 61.91 110.277 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.413 HD11 ' HA3' ' A' ' 89' ' ' GLY . 59.0 tp -69.34 -40.53 77.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.15 -0.932 . . . . 321.59 111.677 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 24' ' ' ILE . 65.0 tttm -59.74 -39.48 84.91 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.846 -0.616 . . . . 491.97 112.309 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.54 -43.7 98.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.396 0.141 . . . . 179.68 111.019 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.89 -41.53 97.69 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.721 0.296 . . . . 483.12 110.855 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.468 HG21 ' SD ' ' A' ' 58' ' ' MET . 97.1 mt -63.3 -44.55 99.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.063 -0.517 . . . . 120.91 110.873 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 20' ' ' LYS . 36.2 mm -60.68 -43.04 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 324.41 111.37 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.49 -42.84 97.14 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.8 -0.182 . . . . 76.38 111.397 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.97 -41.85 98.49 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.88 -0.676 . . . . 59.56 112.761 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -73.6 -23.8 59.97 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.885 0.328 . . . . 169.43 111.885 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -78.54 -30.17 46.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.464 -0.335 . . . . 145.09 111.427 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -62.79 -42.25 99.62 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.85 0.357 . . . . 779.77 110.83 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.96 -26.76 52.45 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.673 -0.775 . . . . 72.33 112.457 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.9 tp -65.55 -43.09 90.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.486 0.184 . . . . 213.67 111.393 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.36 -33.71 65.31 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 C-N-CA 121.015 -0.274 . . . . 275.82 111.336 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.62 -40.61 95.79 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 121.334 0.588 . . . . 545.0 109.701 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -64.91 -41.75 95.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.168 -0.923 . . . . 999.99 109.588 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.86 -37.04 83.01 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.228 -0.896 . . . . 205.93 111.146 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -62.43 -37.13 84.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.615 0.245 . . . . 557.46 111.42 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.86 -50.06 14.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 113.424 0.898 . . . . 284.57 113.424 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -107.51 -29.74 9.03 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -69.19 -13.01 66.65 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.093 -0.575 . . . . 199.7 113.82 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.437 ' HG3' HG23 ' A' ' 41' ' ' THR . 40.8 ptt180 -64.09 -22.04 66.77 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.87 0.335 . . . . 999.99 111.708 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.437 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.0 p -105.88 -15.35 14.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.953 0.406 . . . . 302.8 111.525 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -73.63 148.76 42.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 581.97 111.546 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -76.97 167.21 22.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.995 -0.548 . . . . 239.07 110.57 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -64.7 -32.07 73.58 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.987 0.366 . . . . 192.01 111.987 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.427 HG12 ' HB3' ' A' ' 114' ' ' TYR . 0.4 OUTLIER -69.03 -39.77 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.958 0.408 . . . . 278.45 110.198 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.545 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 90.1 mt-30 -64.99 -41.32 95.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.829 -0.623 . . . . 316.42 110.879 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.27 -45.33 92.0 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.078 -0.51 . . . . 470.35 110.785 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.27 -38.45 91.08 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.716 -0.675 . . . . 369.78 110.823 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.02 85.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.887 -0.597 . . . . 66.79 111.528 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.411 ' HA ' HG22 ' A' ' 53' ' ' VAL . 88.2 mt -62.24 -38.18 88.25 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.414 -0.357 . . . . 238.3 111.558 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -63.05 -39.01 93.45 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.306 -0.627 . . . . 526.93 109.306 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -62.12 -48.06 81.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.344 -0.844 . . . . 162.88 111.608 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.425 HG21 ' CE2' ' A' ' 101' ' ' PHE . 17.2 m -68.89 -24.16 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 C-N-CA 121.016 -0.273 . . . . 139.01 111.679 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.88 -41.37 91.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.53 -0.304 . . . . 198.61 110.569 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -62.96 -41.92 99.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.491 -0.322 . . . . 999.99 110.448 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -63.93 -44.03 94.1 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.166 0.507 . . . . 799.65 110.036 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -60.13 -47.47 85.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.226 -0.897 . . . . 151.58 111.113 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.468 ' SD ' HG21 ' A' ' 23' ' ' ILE . 47.0 ttp -59.33 -45.46 91.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.995 -0.548 . . . . 168.43 111.068 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.658 ' HG2' HG13 ' A' ' 131' ' ' VAL . 56.5 mt-30 -64.7 -41.47 95.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.476 -0.329 . . . . 530.56 111.139 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -66.09 -45.5 80.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.22 -0.446 . . . . 293.49 110.787 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -64.38 -42.36 96.19 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.036 -0.529 . . . . 383.72 110.548 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.43 ' HB2' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -60.11 -41.38 92.44 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.607 -0.724 . . . . 497.0 111.827 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.07 91.26 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.378 0.51 . . . . 177.0 112.378 -178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -62.55 -47.84 82.12 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.984 0.421 . . . . 478.76 111.014 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.418 ' HE2' HD22 ' A' ' 88' ' ' LEU . 55.7 t80 -68.46 -44.35 75.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.916 -0.584 . . . . 727.09 111.188 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 62' ' ' TRP . 0.0 OUTLIER -52.18 -39.11 59.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.566 -0.743 . . . . 664.46 112.893 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.39 -41.62 94.19 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.885 0.328 . . . . 447.74 111.885 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -68.09 -40.47 82.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.977 0.418 . . . . 999.99 110.69 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.429 ' O ' HG12 ' A' ' 73' ' ' ILE . 48.7 mm -70.62 -41.25 77.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.709 -0.678 . . . . 398.95 111.293 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -58.94 -40.95 86.2 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.033 -0.53 . . . . 366.97 111.694 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.91 -43.5 98.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.859 0.361 . . . . 709.01 110.541 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -66.58 -44.92 80.92 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.817 -0.629 . . . . 931.14 110.938 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.2 mm -64.38 -45.01 97.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 115.831 -0.622 . . . . 175.26 111.452 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -61.02 -43.79 98.36 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.309 -0.405 . . . . 443.19 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.21 -40.35 97.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.392 -0.367 . . . . 366.44 111.445 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -70.28 -40.54 74.27 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.422 -0.354 . . . . 386.93 111.486 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.63 -8.0 80.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.962 -0.637 . . . . 244.67 112.688 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -74.64 148.82 40.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 999.99 111.588 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.6 p -103.77 106.24 51.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 263.29 110.94 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 33.0 Cg_exo -60.91 143.88 99.45 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.138 2.559 . . . . 173.89 113.348 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -100.49 -175.78 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 201.66 110.996 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.39 -42.9 89.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-N 116.414 -0.357 . . . . 81.09 110.856 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.536 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -40.43 98.18 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.825 -0.702 . . . . 106.63 112.506 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -64.19 -42.26 96.75 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.851 0.357 . . . . 397.23 110.835 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 48.2 m-85 -71.16 -35.8 71.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.061 -0.518 . . . . 176.41 111.644 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.536 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -62.43 -35.93 80.8 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.575 0.226 . . . . 224.32 110.779 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -63.56 -45.03 92.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.248 0.547 . . . . 999.99 109.98 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.418 HD22 ' HE2' ' A' ' 65' ' ' TYR . 98.0 mt -65.82 -40.66 92.03 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.47 -0.786 . . . . 158.17 110.483 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.413 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.87 -39.48 98.07 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 115.687 -0.688 . . . . 65.71 112.779 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.7 90.07 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.631 0.253 . . . . 95.38 111.198 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.83 -41.84 97.76 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.27 -0.423 . . . . 381.14 110.421 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.89 -42.26 91.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.744 -0.662 . . . . 182.12 111.171 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.49 -9.16 64.3 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.928 -0.578 . . . . 88.8 113.691 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.31 -30.4 54.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.906 0.384 . . . . 999.99 110.86 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -100.89 120.63 40.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 999.99 110.421 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 80.9 mt -116.48 119.72 62.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.528 -0.306 . . . . 308.67 110.773 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -110.97 24.66 12.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.299 -0.409 . . . . 388.05 111.946 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.7 mmm -61.71 -39.1 90.32 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.602 0.239 . . . . 360.57 111.28 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -39.25 90.13 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.035 0.445 . . . . 184.23 110.798 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -66.05 -35.98 82.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.026 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.425 ' CE2' HG21 ' A' ' 53' ' ' VAL . 87.5 t80 -58.9 -48.95 79.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.329 -0.396 . . . . 374.13 110.514 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -61.01 -47.8 84.74 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.922 -0.581 . . . . 999.99 110.798 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.56 -39.62 91.77 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.8 -0.636 . . . . 558.87 111.776 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.26 98.49 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.551 -0.295 . . . . 332.85 111.393 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 91.0 mt -64.79 -40.81 95.85 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.384 -0.371 . . . . 472.21 110.722 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.43 -43.68 96.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.892 -0.595 . . . . 821.44 111.096 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.85 -40.12 83.31 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.122 -0.49 . . . . 746.24 112.023 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -89.01 -7.24 56.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.587 -0.279 . . . . 999.99 111.287 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 52.9 t30 58.43 32.41 22.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.826 -0.625 . . . . 675.44 111.258 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 22.4 mmt -107.31 98.5 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.063 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.0 mt -94.24 119.67 66.3 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.022 -0.535 . . . . 390.38 110.514 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.36 150.85 65.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.454 2.102 . . . . 243.11 112.163 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -84.8 118.31 24.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.842 0.353 . . . . 618.1 110.56 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.545 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 23.7 m-85 -70.33 107.71 3.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.84 -0.618 . . . . 999.99 111.043 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.72 143.5 26.33 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.605 -0.271 . . . . 415.25 111.264 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -58.25 -35.07 99.07 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.071 2.514 . . . . 529.15 112.933 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -63.02 -34.18 77.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.25 -0.432 . . . . 516.88 111.027 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 95.8 mtp -60.17 -40.07 88.64 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.884 0.373 . . . . 914.6 110.129 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.03 -39.9 93.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.755 -0.657 . . . . 675.31 110.183 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 124' ' ' MET . 88.5 tt0 -62.92 -41.68 99.55 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.608 -0.723 . . . . 900.95 111.146 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.56 -42.37 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.813 0.34 . . . . 300.73 110.724 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.87 -38.57 82.54 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.08 -0.509 . . . . 595.29 111.129 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -77.71 -9.66 59.11 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.336 0.495 . . . . 999.99 112.336 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 68.1 mtt -71.54 139.22 49.39 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.653 0.264 . . . . 385.68 111.107 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -52.33 136.13 41.14 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.904 -0.589 . . . . 999.99 111.263 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -54.31 -36.88 88.13 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.039 2.493 . . . . 149.6 113.079 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.411 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -64.3 -25.48 68.07 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.3 -0.409 . . . . 147.02 111.851 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -92.03 -1.77 57.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.455 -0.339 . . . . 360.37 111.383 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 60.1 t -99.94 112.98 64.93 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.669 -0.241 . . . . 187.93 110.745 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.23 152.58 61.73 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.501 2.134 . . . . 265.39 112.347 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.658 HG13 ' HG2' ' A' ' 59' ' ' GLN . 96.7 t -124.38 135.8 62.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 246.78 110.275 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -133.28 134.71 44.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.385 -0.371 . . . . 999.99 110.419 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -84.74 92.46 8.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.981 0.42 . . . . 495.41 110.371 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.282 -0.866 . . . . 761.34 111.345 -179.706 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.478 ' HB ' ' OD1' ' A' ' 70' ' ' ASN . 73.1 t . . . . . 0 C--O 1.232 0.177 0 N-CA-C 109.852 -0.425 . . . . 375.52 109.852 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -81.36 125.15 79.67 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.597 -0.274 . . . . 999.99 110.826 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.72 151.73 63.81 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.698 2.265 . . . . 436.63 112.788 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -132.76 134.89 45.31 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 999.99 109.722 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 63.81 33.67 12.55 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.582 0.551 . . . . 999.99 111.49 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -56.26 120.45 7.61 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.257 -0.429 . . . . 781.6 110.953 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -91.48 106.49 18.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.43 -0.35 . . . . 216.75 111.055 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.32 -22.11 66.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.93 -0.577 . . . . 902.9 111.819 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.44 81.43 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.804 0.335 . . . . 121.35 111.488 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -63.4 -37.29 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 265.05 109.98 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.76 -39.37 93.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.745 -0.661 . . . . 524.44 110.419 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.59 -46.92 95.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.812 -0.631 . . . . 214.56 111.285 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.01 99.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.22 -0.445 . . . . 61.91 111.256 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 85' ' ' TYR . 91.0 mt -67.21 -37.98 84.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.838 -0.619 . . . . 321.59 111.306 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.15 -39.7 83.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.736 -0.665 . . . . 491.97 111.586 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 74.1 t -62.82 -44.26 99.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.606 0.241 . . . . 179.68 110.657 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.82 -40.22 91.63 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.939 0.4 . . . . 483.12 110.744 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.07 -41.98 94.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.748 -0.66 . . . . 120.91 111.317 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.5 mt -60.05 -43.15 92.05 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.49 -0.323 . . . . 324.41 111.193 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -43.98 97.36 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.598 0.237 . . . . 76.38 111.228 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.48 -40.18 96.08 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.068 -0.587 . . . . 59.56 112.495 178.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -72.78 -20.49 61.16 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.384 0.273 . . . . 169.43 111.489 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.37 -36.42 60.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.535 -0.302 . . . . 145.09 110.557 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -60.84 -44.12 97.4 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.329 -0.619 . . . . 779.77 109.329 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.63 -39.07 97.43 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.475 -0.784 . . . . 72.33 112.215 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 83.2 mt -62.14 -40.51 96.19 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.458 0.171 . . . . 213.67 111.058 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.4 t -60.96 -43.97 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.191 -0.459 . . . . 275.82 110.702 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.72 -44.6 96.42 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.147 -0.479 . . . . 545.0 111.02 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -68.03 -38.42 82.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.925 0.393 . . . . 999.99 110.179 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.6 mt -62.17 -37.0 83.56 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.929 -0.578 . . . . 205.93 111.611 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -61.87 -37.12 83.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.601 0.238 . . . . 557.46 111.543 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.5 t -87.82 -52.5 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 113.502 0.926 . . . . 284.57 113.502 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -115.36 -5.74 12.32 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.244 0.831 . . . . 350.44 113.244 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.94 -37.86 93.27 Favored Glycine 0 N--CA 1.46 0.282 0 C-N-CA 121.29 -0.481 . . . . 199.7 113.685 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.405 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.8 ptm180 -62.01 -18.66 61.26 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.265 0.468 . . . . 999.99 112.265 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.405 HG23 ' HG3' ' A' ' 40' ' ' ARG . 73.5 p -106.15 1.07 25.9 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.409 0.522 . . . . 302.8 112.409 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.424 HD12 ' HA2' ' A' ' 39' ' ' GLY . 86.8 mt -72.27 141.22 48.91 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.0 0.429 . . . . 581.97 111.962 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.0 m -77.78 162.77 26.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.746 -0.661 . . . . 239.07 110.495 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.9 m -60.02 -42.39 94.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.818 0.342 . . . . 192.01 110.96 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.617 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.7 t -65.89 -41.96 91.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.125 -0.488 . . . . 278.45 110.799 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.15 -40.91 98.94 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.21 -0.45 . . . . 316.42 111.178 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 64.2 tttm -61.47 -45.7 93.13 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.386 -0.37 . . . . 470.35 110.924 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.03 -38.72 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 369.78 111.019 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.21 -22.94 66.34 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.729 -0.668 . . . . 66.79 112.433 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -53.85 -36.27 62.4 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.384 0.512 . . . . 238.3 112.384 -179.303 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -62.41 -41.21 98.51 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.796 0.331 . . . . 526.93 110.785 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -70.43 -37.61 74.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 162.88 110.22 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.34 -41.22 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.669 -0.696 . . . . 139.01 111.014 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -59.99 -39.79 86.96 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.778 -0.192 . . . . 198.61 110.943 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -61.62 -46.15 91.04 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.789 0.328 . . . . 999.99 110.235 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -63.28 -41.72 99.03 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.979 -0.555 . . . . 799.65 110.61 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -61.77 -41.52 97.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.568 -0.742 . . . . 151.58 110.036 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 98.2 mtp -64.97 -38.55 91.32 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.961 -0.563 . . . . 168.43 111.364 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.03 -40.9 95.36 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.833 0.679 . . . . 530.56 112.833 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.471 ' HA ' ' SD ' ' A' ' 134' ' ' MET . 75.8 p -68.46 -38.85 81.48 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.694 -0.402 . . . . 293.49 111.371 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.474 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 69.9 m80 -70.7 -40.13 73.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.351 -0.386 . . . . 383.72 111.206 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.423 ' HH2' HD13 ' A' ' 19' ' ' LEU . 30.7 m95 -63.85 -39.84 95.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 497.0 112.206 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.73 90.65 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.828 0.307 . . . . 177.0 111.828 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -65.04 -46.86 79.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.828 0.347 . . . . 478.76 111.486 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.492 ' O ' HG12 ' A' ' 69' ' ' ILE . 62.7 m-85 -70.54 -40.52 73.35 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.346 -0.388 . . . . 727.09 112.025 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 17.7 tpt -53.76 -50.13 66.71 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.184 0.438 . . . . 664.46 112.184 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.95 -39.96 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.957 0.354 . . . . 447.74 111.957 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -61.99 -47.88 82.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 999.99 111.67 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.7 pt -80.11 -24.63 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.43 0.53 . . . . 398.95 112.43 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.478 ' OD1' ' HB ' ' A' ' 6' ' ' VAL . 28.6 t-20 -58.73 -45.52 89.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.613 0.227 . . . . 366.97 111.613 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.23 -41.73 96.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.548 -0.296 . . . . 709.01 111.237 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -70.06 -42.7 72.51 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.135 0.42 . . . . 931.14 112.135 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.83 -46.62 95.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.578 0.228 . . . . 175.26 111.433 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.58 -46.89 86.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.465 -0.334 . . . . 443.19 111.757 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.51 -41.16 96.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.171 0.434 . . . . 366.44 112.171 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.13 -40.6 71.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.875 0.369 . . . . 386.93 111.594 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.1 -8.23 78.93 Favored Glycine 0 CA--C 1.52 0.36 0 C-N-CA 121.042 -0.599 . . . . 244.67 112.287 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.8 mmt-85 -75.22 150.65 38.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.944 0.402 . . . . 999.99 111.546 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 p -107.42 100.98 36.86 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 263.29 110.634 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.516 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 46.0 Cg_exo -59.51 140.98 96.58 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.022 2.481 . . . . 173.89 113.398 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.29 -175.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.766 -0.652 . . . . 201.66 111.115 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.6 t -59.31 -41.6 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 116.375 -0.375 . . . . 81.09 110.909 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.577 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.38 -40.68 97.88 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.815 -0.707 . . . . 106.63 112.536 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -70.1 -42.29 72.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.018 0.437 . . . . 397.23 110.803 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.723 ' HB3' HD11 ' A' ' 19' ' ' LEU . 26.5 m-85 -68.0 -34.13 75.94 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.809 -0.632 . . . . 176.41 112.687 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -56.03 -32.57 64.13 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.686 0.254 . . . . 224.32 111.686 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -62.48 -45.42 93.11 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.05 0.453 . . . . 999.99 109.982 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.3 mt -66.12 -40.78 90.94 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.695 -0.684 . . . . 158.17 110.559 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.53 -40.64 99.37 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.661 -0.699 . . . . 65.71 112.364 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.91 -40.01 94.0 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.521 0.201 . . . . 95.38 110.836 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -63.44 -40.12 96.31 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.213 -0.449 . . . . 381.14 110.567 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.73 -42.69 96.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.996 -0.547 . . . . 182.12 110.517 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.33 -10.44 66.12 Favored Glycine 0 CA--C 1.522 0.488 0 CA-C-N 115.689 -0.687 . . . . 88.8 113.747 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.1 mmm180 -79.85 -13.92 59.05 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 117.107 0.454 . . . . 999.99 111.332 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -97.3 114.33 26.08 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.714 -0.476 . . . . 999.99 109.714 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.2 pt -121.8 23.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.325 -0.398 . . . . 308.67 111.817 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -81.64 77.94 8.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 388.05 111.034 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 67.4 mtt -91.75 -2.65 56.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.059 -0.519 . . . . 360.57 110.817 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.31 -37.3 82.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.819 -0.628 . . . . 184.23 110.898 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -58.64 -44.94 90.23 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.472 -0.785 . . . . 999.99 111.205 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.67 -48.3 77.91 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.443 -0.344 . . . . 374.13 111.285 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -65.0 -39.84 94.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 999.99 111.051 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.34 -41.8 98.9 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.064 -0.516 . . . . 558.87 110.69 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.82 92.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.929 -0.578 . . . . 332.85 111.466 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.0 -42.07 99.75 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.43 -0.35 . . . . 472.21 110.862 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -63.72 -39.52 94.51 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 116.339 -0.392 . . . . 821.44 110.953 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.84 -39.8 82.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.063 -0.517 . . . . 746.24 111.545 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -84.56 -11.91 55.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.344 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.9 t30 54.38 42.96 31.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.953 -0.567 . . . . 675.44 111.524 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 63.3 tpp -127.87 118.64 24.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 999.99 111.107 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.0 mt -94.82 119.04 66.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 390.38 110.085 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.27 140.48 37.22 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.243 1.962 . . . . 243.11 112.83 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -85.88 150.39 24.56 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.063 -0.517 . . . . 618.1 110.846 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.617 ' HB2' HG13 ' A' ' 45' ' ' VAL . 50.5 t80 -67.61 125.27 25.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.784 0.326 . . . . 999.99 110.483 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.8 mt -98.96 145.61 30.26 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 415.25 111.336 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.86 -24.43 53.84 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.637 2.225 . . . . 529.15 111.97 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.85 -34.92 78.35 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.502 -0.772 . . . . 516.88 110.915 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.9 mtt -59.95 -39.5 85.78 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.091 -0.504 . . . . 914.6 110.483 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -61.44 -41.59 97.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.104 -0.498 . . . . 675.31 110.674 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -64.78 -42.18 95.28 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.074 -0.512 . . . . 900.95 110.828 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.8 mm -62.02 -46.65 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.088 -0.505 . . . . 300.73 111.07 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.5 -41.93 96.13 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.138 -0.483 . . . . 595.29 112.189 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -65.1 -35.81 82.31 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.448 0.536 . . . . 999.99 112.448 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.4 mtm -90.73 134.5 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.036 0.384 . . . . 385.68 112.036 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -53.09 146.13 21.41 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.755 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.24 -37.54 88.11 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.028 2.485 . . . . 149.6 112.949 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.77 -19.76 61.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.289 -0.414 . . . . 147.02 112.072 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -91.59 -21.67 20.71 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.185 0.439 . . . . 360.37 112.185 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.4 m -90.65 146.71 34.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.848 0.356 . . . . 187.93 111.306 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.53 156.73 53.75 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.702 2.268 . . . . 265.39 112.952 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.8 t -115.87 137.08 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.34 -0.615 . . . . 246.78 109.34 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -144.59 140.88 29.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.603 -0.271 . . . . 999.99 110.573 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -82.83 175.59 9.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.085 -0.507 . . . . 495.41 110.302 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.471 ' SD ' ' HA ' ' A' ' 60' ' ' THR . 27.9 ptm . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.3 -0.857 . . . . 761.34 110.961 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 71.3 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.629 0.252 . . . . 375.52 110.354 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -82.46 147.44 56.25 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.477 -0.329 . . . . 999.99 110.901 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.71 152.41 47.66 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.73 2.287 . . . . 436.63 112.861 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -88.95 61.27 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.458 -0.337 . . . . 999.99 111.457 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 54.94 47.74 21.52 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.783 -0.644 . . . . 999.99 112.237 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.8 mt -56.68 142.27 40.68 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.322 -0.399 . . . . 781.6 111.064 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.37 114.06 19.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 216.75 111.102 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -64.12 -24.11 67.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.81 -0.632 . . . . 902.9 111.999 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.91 -39.16 84.48 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.885 0.374 . . . . 121.35 111.182 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -65.35 -34.88 79.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 265.05 109.965 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -64.15 -40.12 95.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.567 -0.742 . . . . 524.44 110.1 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.06 -46.87 95.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.774 -0.648 . . . . 214.56 111.186 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.04 -41.6 98.29 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.0 -0.546 . . . . 61.91 111.059 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 85' ' ' TYR . 62.4 tp -67.98 -41.03 82.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 321.59 111.428 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.98 -40.48 84.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.95 -0.568 . . . . 491.97 111.78 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.21 -43.78 98.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.726 0.298 . . . . 179.68 110.535 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.66 -39.12 91.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.393 . . . . 483.12 110.947 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.48 -42.37 95.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.153 -0.476 . . . . 120.91 110.603 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 91.9 mt -60.06 -41.14 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.693 -0.685 . . . . 324.41 111.642 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.51 -43.29 93.43 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.724 0.268 . . . . 76.38 111.724 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.44 -41.82 97.85 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.684 -0.77 . . . . 59.56 112.515 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -74.26 -18.29 60.75 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.963 0.357 . . . . 169.43 111.963 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.422 ' HA ' HD12 ' A' ' 31' ' ' LEU . 34.0 t70 -75.79 -31.49 59.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.401 -0.363 . . . . 145.09 110.908 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -62.8 -39.71 95.08 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.366 -0.605 . . . . 779.77 109.366 178.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.65 -35.78 91.69 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.376 -0.829 . . . . 72.33 112.409 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 54' ' ' ASN . 77.0 mt -61.88 -42.77 99.46 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.078 0.399 . . . . 213.67 112.078 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 33.5 m -74.23 -32.2 31.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 C-N-CA 120.651 -0.42 . . . . 275.82 111.298 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.09 -40.64 94.88 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.919 0.39 . . . . 545.0 110.576 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.522 ' HZ3' HD22 ' A' ' 42' ' ' LEU . 59.0 t90 -66.44 -39.5 88.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.031 -0.532 . . . . 999.99 109.582 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.13 -37.04 83.65 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.561 -0.745 . . . . 205.93 111.071 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.18 -36.66 84.36 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.644 0.259 . . . . 557.46 111.464 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.04 -51.62 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 113.599 0.963 . . . . 284.57 113.599 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -108.55 -4.67 17.01 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.274 0.842 . . . . 350.44 113.274 -177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.28 -12.23 72.28 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.125 -0.559 . . . . 199.7 113.95 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -61.18 -40.22 93.09 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.818 0.309 . . . . 999.99 111.339 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.8 p -112.36 8.7 19.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.517 -0.31 . . . . 302.8 111.796 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 ' HZ3' ' A' ' 34' ' ' TRP . 30.0 tp -71.46 131.69 43.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.373 -0.376 . . . . 581.97 111.32 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.0 t -70.54 152.34 44.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.136 -0.483 . . . . 239.07 110.732 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.7 m -59.88 -41.48 91.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.184 -0.462 . . . . 192.01 111.367 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 45' ' ' VAL . 2.1 t -68.76 -37.35 77.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.885 0.374 . . . . 278.45 110.464 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.43 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 97.5 mt-30 -64.13 -38.28 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.973 -0.558 . . . . 316.42 111.073 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.04 -45.11 93.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 470.35 110.682 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -63.47 -40.4 97.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.003 0.43 . . . . 369.78 110.408 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.07 91.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.705 -0.68 . . . . 66.79 111.338 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.95 -44.13 94.58 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.932 -0.576 . . . . 238.3 111.78 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -62.21 -40.25 95.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 526.93 110.288 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -62.72 -44.78 95.35 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.129 -0.487 . . . . 162.88 110.012 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 56.7 t -60.36 -40.43 83.96 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 CA-C-N 115.903 -0.589 . . . . 139.01 110.097 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB2' HD21 ' A' ' 31' ' ' LEU . 28.9 t-20 -58.93 -45.34 90.63 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.387 -0.37 . . . . 198.61 110.714 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -64.27 -42.46 96.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.762 0.315 . . . . 999.99 110.859 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -63.85 -44.71 92.35 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.234 0.54 . . . . 799.65 110.099 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -60.71 -46.95 88.43 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.249 -0.887 . . . . 151.58 110.936 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.9 ttp -59.45 -44.59 92.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.181 -0.463 . . . . 168.43 110.955 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -64.33 -42.23 96.39 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.882 0.372 . . . . 530.56 110.731 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.1 m -64.72 -44.89 88.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.886 -0.597 . . . . 293.49 110.772 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -63.96 -44.92 91.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.783 -0.644 . . . . 383.72 110.268 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -62.06 -45.1 95.05 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.65 -0.704 . . . . 497.0 111.713 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.45 79.66 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.396 0.517 . . . . 177.0 112.396 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -61.07 -48.54 81.27 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.643 0.259 . . . . 478.76 110.85 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -71.63 -39.02 70.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.413 . . . . 727.09 111.612 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 28.1 ttt -52.16 -46.27 65.41 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.551 0.575 . . . . 664.46 112.551 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.66 -42.14 96.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.713 -0.221 . . . . 447.74 111.331 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -68.67 -40.14 80.28 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.977 0.418 . . . . 999.99 110.492 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.3 -44.13 98.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 115.6 -0.727 . . . . 398.95 110.496 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.85 -41.49 91.56 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.06 -0.518 . . . . 366.97 111.2 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.99 -42.33 99.02 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.53 -0.305 . . . . 709.01 110.682 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.9 -41.59 91.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.148 -0.478 . . . . 931.14 110.808 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.541 HD13 ' HG3' ' A' ' 80' ' ' PRO . 95.0 mt -62.67 -46.23 96.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.911 -0.586 . . . . 175.26 110.663 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -61.59 -45.09 95.6 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.99 -0.55 . . . . 443.19 111.508 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.23 -41.01 99.05 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.47 -0.332 . . . . 366.44 111.764 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.94 -41.01 71.69 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.027 0.442 . . . . 386.93 111.345 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.33 -11.1 70.81 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.875 -0.602 . . . . 244.67 112.504 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.6 mpt_? -75.64 145.7 40.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.782 0.325 . . . . 999.99 111.432 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.0 t -91.6 116.53 66.63 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 121.009 0.433 . . . . 263.29 110.567 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.541 ' HG3' HD13 ' A' ' 73' ' ' ILE . 69.6 Cg_endo -72.66 145.12 40.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.617 2.212 . . . . 173.89 113.304 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 m -102.07 178.47 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 201.66 110.849 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.0 t -60.83 -42.53 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.241 -0.436 . . . . 81.09 110.517 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.28 -39.58 96.24 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 121.107 -0.568 . . . . 106.63 112.777 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.91 -40.58 95.95 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.023 0.439 . . . . 397.23 110.259 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD22 ' A' ' 19' ' ' LEU . 36.5 m-85 -67.44 -39.08 85.4 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.617 -0.719 . . . . 176.41 111.763 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.6 p -65.81 -34.81 79.03 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 111.9 0.333 . . . . 224.32 111.9 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -64.79 -41.54 95.76 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.005 0.431 . . . . 999.99 110.172 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -69.88 -40.5 75.65 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.698 -0.683 . . . . 158.17 110.623 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.8 -39.86 98.51 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.599 -0.728 . . . . 65.71 113.004 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.21 96.28 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.662 0.267 . . . . 95.38 111.135 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.67 -40.82 97.8 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.262 -0.426 . . . . 381.14 110.674 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.45 -42.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.811 -0.631 . . . . 182.12 110.865 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.95 -16.85 62.4 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.933 -0.576 . . . . 88.8 113.542 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -79.85 -13.82 59.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.864 0.332 . . . . 999.99 111.227 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -108.22 114.71 28.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 999.99 110.584 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.403 HG22 ' H ' ' A' ' 98' ' ' MET . 75.6 mt -125.52 118.59 52.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 308.67 110.471 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -106.02 19.27 20.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.544 -0.298 . . . . 388.05 111.789 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.41 ' O ' ' HB3' ' A' ' 101' ' ' PHE . 98.0 mtp -62.29 -38.3 88.83 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.04 0.385 . . . . 360.57 112.04 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.1 -39.59 90.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.096 0.474 . . . . 184.23 110.551 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.75 -24.48 59.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.666 -0.697 . . . . 999.99 111.269 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 98' ' ' MET . 86.8 t80 -58.16 -48.71 79.45 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.14 -0.482 . . . . 374.13 110.995 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.09 -39.46 94.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.393 -0.367 . . . . 999.99 111.005 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.92 -44.9 95.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.195 -0.457 . . . . 558.87 110.903 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.76 -41.23 99.13 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.104 -0.498 . . . . 332.85 111.319 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.99 -45.12 86.92 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.159 -0.473 . . . . 472.21 111.258 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -64.61 -39.82 94.41 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.482 -0.326 . . . . 821.44 111.269 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.06 -43.89 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.162 -0.472 . . . . 746.24 111.99 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -91.38 -3.76 56.4 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.412 -0.358 . . . . 999.99 111.317 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.4 t30 57.53 37.44 27.66 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.235 0.614 . . . . 675.44 111.139 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 38.6 mmt -105.8 83.57 1.94 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.982 -0.554 . . . . 999.99 110.675 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.51 116.67 66.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.458 -0.337 . . . . 390.38 110.789 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.37 157.68 45.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.728 2.285 . . . . 243.11 112.651 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -80.12 126.27 30.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.464 -0.335 . . . . 618.1 110.348 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 16.1 m-85 -70.03 90.96 0.66 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 999.99 111.33 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.7 145.31 29.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.485 -0.325 . . . . 415.25 110.477 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -79.51 45.3 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.493 2.129 . . . . 529.15 113.009 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -70.58 -29.22 65.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 516.88 110.393 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' MET . . . . . 0.4 ' HA ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttp -58.7 -43.31 90.02 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.608 -0.724 . . . . 914.6 111.113 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -61.11 -41.44 96.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.536 -0.302 . . . . 675.31 110.621 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.96 -41.22 82.78 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.011 -0.541 . . . . 900.95 111.911 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.4 HG22 ' HA ' ' A' ' 118' ' ' MET . 7.7 tp -73.52 -28.32 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 111.707 0.262 . . . . 300.73 111.707 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -70.21 -17.43 63.14 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.614 -0.266 . . . . 595.29 111.698 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -65.04 -33.13 75.3 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.467 -0.333 . . . . 999.99 111.614 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.4 mtm -95.47 134.63 38.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.643 -0.253 . . . . 385.68 111.174 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.0 mtt-85 -52.53 139.34 39.0 Favored Pre-proline 0 N--CA 1.465 0.281 0 CA-C-N 116.203 -0.453 . . . . 999.99 110.851 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -60.22 -26.09 81.71 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.869 2.379 . . . . 149.6 113.274 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.71 -36.8 81.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 147.02 111.647 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -92.19 -1.2 57.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.389 -0.368 . . . . 360.37 111.961 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.5 t -87.15 120.5 71.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.684 0.278 . . . . 187.93 110.711 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.83 158.4 55.65 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.512 2.142 . . . . 265.39 112.311 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 88.0 t -106.0 137.59 35.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.207 -0.452 . . . . 246.78 110.109 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -78.93 116.56 19.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.023 0.44 . . . . 999.99 110.951 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -84.18 153.28 23.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.83 -0.623 . . . . 495.41 110.623 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.154 -0.927 . . . . 761.34 110.908 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.231 0.126 0 CA-C-O 121.02 0.438 . . . . 375.52 111.116 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.87 150.67 66.1 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.482 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.467 ' HA ' ' OD2' ' A' ' 74' ' ' ASP . 50.5 Cg_endo -68.38 138.2 41.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.268 1.979 . . . . 436.63 112.687 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -102.59 -9.3 20.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.009 -0.542 . . . . 999.99 110.639 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -107.22 9.14 30.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 999.99 111.104 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -57.13 125.92 24.87 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.987 -0.551 . . . . 781.6 111.104 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -108.53 113.94 27.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.507 -0.315 . . . . 216.75 110.38 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 58.3 mtmt -62.48 -39.18 92.64 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.101 -0.5 . . . . 902.9 111.782 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.72 85.8 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.936 0.398 . . . . 121.35 111.54 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -71.34 -29.31 64.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.24 -0.437 . . . . 265.05 110.72 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.416 ' OE1' ' HA ' ' A' ' 13' ' ' LYS . 54.3 mt-10 -64.62 -40.72 95.99 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.899 -0.592 . . . . 524.44 112.115 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 127' ' ' ALA . 27.8 m -68.7 -35.21 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 120.457 -0.497 . . . . 214.56 111.715 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.83 -41.55 95.98 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.002 0.43 . . . . 61.91 110.003 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.748 HD11 ' HA3' ' A' ' 89' ' ' GLY . 58.1 tp -68.82 -40.42 79.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.691 -0.686 . . . . 321.59 111.132 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -60.23 -38.01 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.04 -0.527 . . . . 491.97 111.881 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 69.0 t -63.04 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.622 0.249 . . . . 179.68 110.944 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.29 -41.52 89.68 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.644 0.259 . . . . 483.12 111.261 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.6 mt -70.09 -44.13 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.177 -0.465 . . . . 120.91 111.789 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.445 ' O ' ' HB2' ' A' ' 28' ' ' ASP . 6.3 tp -63.42 -33.9 64.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 CA-C-N 116.289 -0.414 . . . . 324.41 111.85 -178.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.57 -45.98 91.81 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.016 0.376 . . . . 76.38 112.016 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.28 -44.83 84.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.572 -0.823 . . . . 59.56 113.147 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -72.65 -18.66 61.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.194 0.442 . . . . 169.43 112.194 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 34.2 t70 -74.8 -39.48 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.1 -0.24 . . . . 145.09 111.561 -178.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -63.84 -41.34 97.84 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.616 -0.434 . . . . 779.77 110.174 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -41.02 99.84 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.831 -0.622 . . . . 72.33 112.078 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.7 tp -63.53 -44.42 94.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.682 0.277 . . . . 213.67 110.367 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.5 t -61.61 -44.6 98.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-N 116.11 -0.496 . . . . 275.82 110.813 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -62.24 -40.29 95.65 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.51 -0.314 . . . . 545.0 110.977 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.618 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 52.1 t90 -65.33 -42.01 93.38 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.398 -0.593 . . . . 999.99 109.398 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 86.6 mt -62.69 -35.49 79.88 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.271 -0.877 . . . . 205.93 111.296 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.94 -36.08 80.34 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.754 0.279 . . . . 557.46 111.754 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -86.31 -51.03 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 113.684 0.994 . . . . 284.57 113.684 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.619 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.2 m-70 -101.18 0.97 38.57 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.666 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -60.88 -36.48 92.11 Favored Glycine 0 N--CA 1.461 0.327 0 N-CA-C 114.095 0.398 . . . . 199.7 114.095 -179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -58.94 -39.42 81.57 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.818 0.303 . . . . 999.99 111.818 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -89.76 -10.19 46.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.861 0.689 . . . . 302.8 112.861 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.666 HD12 ' HA2' ' A' ' 39' ' ' GLY . 88.1 mt -73.0 138.38 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.89 0.376 . . . . 581.97 111.79 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.6 p -78.16 169.11 18.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 239.07 110.011 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.98 -42.27 98.05 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.751 0.31 . . . . 192.01 110.972 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.562 HG13 ' HB2' ' A' ' 114' ' ' TYR . 75.1 t -66.69 -43.26 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 116.232 -0.44 . . . . 278.45 111.145 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -63.19 -40.29 97.07 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.104 0.409 . . . . 316.42 112.104 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -61.09 -46.15 91.8 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.68 0.276 . . . . 470.35 111.061 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -70.67 -37.66 73.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.352 -0.385 . . . . 369.78 111.101 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.9 -36.77 80.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 66.79 111.888 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.55 -37.08 80.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.056 0.391 . . . . 238.3 112.056 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -61.56 -38.96 89.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.62 -0.511 . . . . 526.93 109.62 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -66.99 -39.32 87.13 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.742 -0.663 . . . . 162.88 109.481 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.16 -39.6 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.544 -0.753 . . . . 139.01 111.062 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -58.31 -42.33 86.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.436 -0.347 . . . . 198.61 110.731 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 94.9 mtm-85 -66.35 -39.35 89.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.152 -0.219 . . . . 999.99 110.46 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -63.51 -38.67 92.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.227 0.537 . . . . 799.65 109.751 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.72 -46.4 89.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.06 -0.973 . . . . 151.58 109.555 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 87.1 mtp -61.49 -42.99 99.63 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.768 -0.651 . . . . 168.43 110.865 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -62.72 -40.01 95.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.663 -0.699 . . . . 530.56 112.301 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -61.22 -49.32 77.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.734 0.302 . . . . 293.49 111.619 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -72.66 -39.31 67.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 383.72 111.92 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -64.58 -43.87 92.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 497.0 112.265 -178.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.64 -39.8 81.56 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.869 0.692 . . . . 177.0 112.869 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -60.8 -47.58 85.67 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.738 -0.21 . . . . 478.76 111.546 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.604 ' HB3' HD22 ' A' ' 88' ' ' LEU . 82.7 m-85 -71.28 -42.44 68.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.703 0.287 . . . . 727.09 111.77 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 96.9 mmm -56.39 -41.82 76.91 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 113.494 0.924 . . . . 664.46 113.494 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.2 tp -58.99 -46.62 87.69 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.189 0.44 . . . . 447.74 112.189 -177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -65.63 -42.45 91.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.863 0.363 . . . . 999.99 111.267 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.532 HG13 HD11 ' A' ' 88' ' ' LEU . 49.2 mm -72.0 -43.77 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 116.016 -0.538 . . . . 398.95 112.098 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.35 -38.77 88.18 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.942 0.349 . . . . 366.97 111.942 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -59.96 -45.94 91.01 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.697 -0.483 . . . . 709.01 109.697 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.89 -40.97 92.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.894 -0.594 . . . . 931.14 110.972 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 92.5 mt -62.26 -48.09 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.34 -0.391 . . . . 175.26 111.2 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.467 ' OD2' ' HA ' ' A' ' 8' ' ' PRO . 95.5 m-20 -63.39 -42.63 98.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 443.19 111.712 -179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.06 89.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 366.44 112.016 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -40.15 61.56 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.851 0.357 . . . . 386.93 111.55 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.28 -9.95 73.94 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.152 -0.547 . . . . 244.67 112.827 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -75.31 133.94 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.381 -0.229 . . . . 999.99 110.381 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.8 p -73.93 139.38 76.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.785 -0.189 . . . . 263.29 111.12 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.58 145.05 32.7 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.505 2.136 . . . . 173.89 113.203 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.7 m -102.68 170.23 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.936 -0.575 . . . . 201.66 110.854 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.92 -40.08 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.758 0.313 . . . . 81.09 110.461 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.1 -38.86 93.64 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.071 -0.513 . . . . 106.63 112.444 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.444 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.8 t70 -61.66 -42.71 99.28 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.96 -0.385 . . . . 397.23 109.96 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.512 ' HB3' HD22 ' A' ' 19' ' ' LEU . 56.9 m-85 -66.3 -40.45 89.99 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.755 -0.657 . . . . 176.41 111.27 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.7 p -66.12 -32.98 74.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.595 0.22 . . . . 224.32 111.595 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -61.73 -46.07 91.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.405 -0.591 . . . . 999.99 109.405 178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 65' ' ' TYR . 92.9 mt -66.75 -40.74 88.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.465 -0.789 . . . . 158.17 110.347 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.748 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.61 -39.57 98.05 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.439 -0.8 . . . . 65.71 113.685 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -60.54 -40.48 91.7 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.695 0.283 . . . . 95.38 110.988 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.61 -40.5 95.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.981 -0.554 . . . . 381.14 110.241 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.73 -43.43 96.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.56 -0.746 . . . . 182.12 111.146 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.24 -13.92 63.18 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-N 115.824 -0.625 . . . . 88.8 114.001 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -79.38 -15.66 57.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.305 0.552 . . . . 999.99 111.479 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -108.66 111.81 23.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 999.99 110.93 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 77.4 mt -124.47 120.35 58.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.809 -0.441 . . . . 308.67 109.809 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -152.6 55.21 0.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 388.05 111.2 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.4 mmm -64.48 -38.83 92.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.009 -0.542 . . . . 360.57 111.704 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.38 89.37 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 184.23 111.675 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -60.02 -47.52 85.51 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.918 -0.583 . . . . 999.99 111.637 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -57.75 -45.73 85.49 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.122 0.264 . . . . 374.13 111.062 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.56 -48.13 82.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.569 0.223 . . . . 999.99 110.546 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.94 -41.69 99.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.417 -0.356 . . . . 558.87 110.98 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.48 94.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.101 -0.5 . . . . 332.85 111.055 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 110' ' ' MET . 59.6 tp -61.07 -43.79 98.35 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.652 -0.703 . . . . 472.21 110.587 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -62.96 -39.84 95.87 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.189 -0.46 . . . . 821.44 110.557 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.38 -40.36 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.741 -0.663 . . . . 746.24 111.503 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -82.74 -11.52 58.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.324 -0.398 . . . . 999.99 111.507 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.9 t30 54.89 44.91 27.59 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.527 0.517 . . . . 675.44 111.576 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' MET . . . . . 0.417 ' O ' HD11 ' A' ' 105' ' ' LEU . 66.9 mtt -115.39 83.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 999.99 110.878 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.8 mm -93.42 116.81 67.02 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.657 0.265 . . . . 390.38 110.642 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.54 150.31 45.56 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.718 2.279 . . . . 243.11 112.754 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -84.25 142.18 30.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 618.1 110.225 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.562 ' HB2' HG13 ' A' ' 45' ' ' VAL . 67.3 t80 -68.13 113.77 6.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 999.99 110.653 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -99.31 148.63 34.92 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.099 -0.5 . . . . 415.25 111.364 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.93 -19.2 58.33 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.841 2.361 . . . . 529.15 111.873 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -61.53 -35.88 78.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.743 . . . . 516.88 110.855 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 17.8 tpt -58.41 -42.23 86.72 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.081 -0.508 . . . . 914.6 110.574 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.17 -40.4 93.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.16 -0.473 . . . . 675.31 110.429 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -63.66 -42.31 98.1 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.115 -0.493 . . . . 900.95 111.031 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 32.0 mm -61.67 -45.14 99.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 116.433 -0.349 . . . . 300.73 110.807 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.968 -0.56 . . . . 595.29 111.524 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -67.6 -33.66 75.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.293 0.479 . . . . 999.99 112.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -80.3 137.36 36.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 385.68 112.034 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.481 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.2 mtt-85 -53.5 144.04 34.28 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.413 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.46 -33.77 68.89 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.116 2.544 . . . . 149.6 112.86 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -60.75 -35.94 77.66 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.066 -0.515 . . . . 147.02 111.809 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -91.27 0.97 57.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.41 -0.359 . . . . 360.37 111.944 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 125' ' ' ARG . 57.5 t -96.0 111.15 55.25 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.779 0.323 . . . . 187.93 110.811 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -77.04 163.05 31.29 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.782 2.321 . . . . 265.39 112.969 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.4 m -120.9 153.92 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.053 -0.521 . . . . 246.78 109.857 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -116.75 124.06 48.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.041 0.448 . . . . 999.99 111.352 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -83.2 148.95 27.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 495.41 109.825 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.032 -0.985 . . . . 761.34 110.945 -179.503 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.498 HG21 ' HG2' ' A' ' 71' ' ' LYS . 61.4 t . . . . . 0 C--O 1.231 0.095 0 N-CA-C 110.22 -0.289 . . . . 375.52 110.22 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 96.6 mt-10 -90.72 121.94 67.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.494 -0.321 . . . . 999.99 110.982 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 48.6 Cg_exo -59.91 146.86 94.79 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.7 2.267 . . . . 436.63 112.06 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -61.64 -40.29 94.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.331 -0.395 . . . . 999.99 111.777 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -148.81 90.2 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.179 -0.208 . . . . 999.99 111.084 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 56.9 tp -58.98 122.91 14.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.276 -0.42 . . . . 781.6 110.381 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -101.43 102.65 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.921 0.391 . . . . 216.75 110.61 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -65.06 -38.51 91.04 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.799 -0.637 . . . . 902.9 112.052 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.71 84.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.043 0.386 . . . . 121.35 112.043 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.018 -0.364 . . . . 265.05 110.018 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -63.89 -40.58 96.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.875 -0.602 . . . . 524.44 110.456 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -62.18 -47.32 93.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.963 -0.562 . . . . 214.56 111.19 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.94 98.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 61.91 111.453 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 85' ' ' TYR . 85.3 mt -69.06 -39.01 79.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.273 0.471 . . . . 321.59 112.273 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.561 ' HE3' HG21 ' A' ' 131' ' ' VAL . 6.3 mttm -57.56 -42.85 83.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.861 1.06 . . . . 491.97 113.861 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.29 -37.23 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.211 -0.595 . . . . 179.68 111.232 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -70.89 -39.89 72.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 483.12 110.718 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.419 HG21 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -63.58 -43.64 98.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.672 -0.694 . . . . 120.91 111.177 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -59.64 -42.83 89.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.008 -0.542 . . . . 324.41 111.409 -178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.51 96.7 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.042 -0.263 . . . . 76.38 111.385 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.26 -42.87 93.92 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 120.898 -0.668 . . . . 59.56 112.938 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -73.37 -20.15 60.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.959 0.355 . . . . 169.43 111.959 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -77.17 -33.89 56.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.662 -0.245 . . . . 145.09 110.732 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -61.55 -42.71 99.23 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 109.807 -0.442 . . . . 779.77 109.807 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.19 -38.67 82.82 Favored Glycine 0 CA--C 1.519 0.293 0 CA-C-N 115.846 -0.615 . . . . 72.33 112.141 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.9 tp -62.87 -44.64 95.58 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.238 0.458 . . . . 213.67 112.238 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.62 -31.79 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 120.799 -0.36 . . . . 275.82 111.588 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -40.79 97.31 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.918 0.39 . . . . 545.0 109.964 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -64.03 -43.85 94.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.599 -0.728 . . . . 999.99 109.904 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.76 -37.58 84.81 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.176 -0.92 . . . . 205.93 111.575 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -68.31 -20.28 64.74 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.983 0.364 . . . . 557.46 111.983 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.1 t -84.09 -41.45 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.914 0.388 . . . . 284.57 111.136 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -103.92 19.08 20.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.884 0.373 . . . . 350.44 110.895 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.51 -35.88 82.13 Favored Glycine 0 N--CA 1.459 0.228 0 CA-C-N 115.529 -0.76 . . . . 199.7 114.122 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -59.74 -39.59 85.25 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.936 0.346 . . . . 999.99 111.936 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.2 p -110.24 12.22 23.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.66 0.615 . . . . 302.8 112.66 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.474 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.35 123.69 22.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 581.97 111.663 -179.328 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.462 ' HB2' ' HB2' ' A' ' 46' ' ' GLN . 70.7 m -78.67 154.66 29.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.092 -0.504 . . . . 239.07 110.491 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -61.1 -46.45 90.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.862 0.319 . . . . 192.01 111.862 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.5 t -73.01 -30.23 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 121.114 0.483 . . . . 278.45 110.452 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.462 ' HB2' ' HB2' ' A' ' 43' ' ' SER . 64.6 tt0 -60.62 -38.98 86.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.462 -0.79 . . . . 316.42 111.27 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -59.29 -46.32 88.87 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 110.342 -0.244 . . . . 470.35 110.342 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.43 -39.4 92.06 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.987 0.422 . . . . 369.78 110.595 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.4 87.82 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.741 -0.663 . . . . 66.79 111.818 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.42 -37.01 72.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.269 -0.423 . . . . 238.3 111.975 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -63.75 -40.75 97.46 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.736 0.303 . . . . 526.93 110.217 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.96 -43.55 92.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.968 -0.56 . . . . 162.88 109.94 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 68.6 t -61.19 -41.03 87.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.487 -0.779 . . . . 139.01 110.077 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -59.7 -42.72 93.64 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.91 -0.586 . . . . 198.61 110.272 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.404 ' NH1' ' HA ' ' A' ' 122' ' ' ASN . 99.2 mtt180 -63.71 -41.61 98.06 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.702 -0.227 . . . . 999.99 110.91 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -62.13 -45.54 93.02 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.024 0.44 . . . . 799.65 110.064 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -60.4 -45.92 91.83 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.602 -0.726 . . . . 151.58 110.156 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.419 ' SD ' HG21 ' A' ' 23' ' ' ILE . 30.3 ttp -58.81 -42.92 90.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.304 -0.862 . . . . 168.43 110.821 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.33 -42.35 98.97 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.276 -0.42 . . . . 530.56 111.832 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.3 p -71.55 -39.09 70.89 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 111.69 0.255 . . . . 293.49 111.69 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -64.25 -45.83 86.42 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.139 0.495 . . . . 383.72 110.406 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.78 -39.65 91.2 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.691 -0.686 . . . . 497.0 112.538 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -43.19 89.64 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.084 0.402 . . . . 177.0 112.084 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.03 -47.41 83.18 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.858 0.361 . . . . 478.76 111.108 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.428 ' HE2' HD23 ' A' ' 88' ' ' LEU . 62.1 t80 -68.38 -44.34 75.38 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.053 -0.521 . . . . 727.09 111.326 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.2 ttp -53.56 -46.03 70.09 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.752 -0.658 . . . . 664.46 112.195 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.9 mt -61.54 -39.88 92.65 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.716 0.265 . . . . 447.74 111.716 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -62.07 -47.79 83.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.448 -0.342 . . . . 999.99 111.656 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 pt -80.42 -28.09 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.671 0.619 . . . . 398.95 112.671 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -61.45 -40.2 93.65 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.526 0.203 . . . . 366.97 111.433 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.498 ' HG2' HG21 ' A' ' 6' ' ' VAL . 98.2 mttt -61.76 -42.18 98.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.488 -0.324 . . . . 709.01 110.592 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -67.96 -42.14 81.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 931.14 111.044 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.86 -46.91 92.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.291 -0.413 . . . . 175.26 111.063 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -63.37 -43.86 96.45 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.211 -0.449 . . . . 443.19 111.471 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.98 95.93 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.214 -0.448 . . . . 366.44 111.823 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.35 -40.68 67.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.473 -0.33 . . . . 386.93 111.173 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -8.17 79.55 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.89 -0.672 . . . . 244.67 112.706 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.0 mtp180 -74.23 142.83 45.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.787 0.327 . . . . 999.99 110.864 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.2 p -103.21 113.07 66.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.487 -0.324 . . . . 263.29 111.146 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.61 151.64 58.62 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.596 2.197 . . . . 173.89 112.829 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -100.68 178.52 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.938 -0.574 . . . . 201.66 111.512 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 86' ' ' THR . 68.5 t -59.71 -43.41 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.868 -0.606 . . . . 81.09 110.937 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.27 -40.84 97.93 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.789 -0.72 . . . . 106.63 112.463 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.001 0.429 . . . . 397.23 110.154 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.555 ' HB3' HD21 ' A' ' 19' ' ' LEU . 22.5 m-85 -64.75 -39.08 93.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.618 -0.719 . . . . 176.41 112.044 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 82' ' ' VAL . 75.9 p -65.87 -33.13 75.12 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.829 0.307 . . . . 224.32 111.829 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -61.94 -47.09 86.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.089 0.471 . . . . 999.99 109.969 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.428 HD23 ' HE2' ' A' ' 65' ' ' TYR . 10.9 mp -70.12 -40.25 74.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.728 -0.669 . . . . 158.17 110.575 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.68 -39.75 97.84 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.74 -0.664 . . . . 65.71 112.81 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.14 93.13 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.738 0.304 . . . . 95.38 110.887 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.23 -40.84 94.59 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.129 -0.487 . . . . 381.14 110.173 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.96 -43.11 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.818 . . . . 182.12 111.183 179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.59 -24.88 66.57 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 116.156 -0.475 . . . . 88.8 113.578 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -81.18 -12.67 59.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 0.329 . . . . 999.99 111.804 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.4 mmt180 -108.38 112.43 24.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.97 0.414 . . . . 999.99 111.366 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 pt -134.32 153.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 308.67 110.623 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -152.93 43.23 0.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.048 0.452 . . . . 388.05 110.664 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.7 mtp -65.23 -36.55 84.51 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.811 -0.631 . . . . 360.57 111.737 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.13 84.14 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.061 -0.518 . . . . 184.23 111.609 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -60.04 -48.41 81.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.551 -0.295 . . . . 999.99 110.694 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -43.53 98.55 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.274 -0.421 . . . . 374.13 110.338 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -47.83 84.25 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.807 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.36 -40.31 93.83 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.252 -0.431 . . . . 558.87 110.899 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.03 99.85 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.409 -0.359 . . . . 332.85 110.924 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.34 -40.81 94.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.048 -0.524 . . . . 472.21 110.663 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.97 -42.6 99.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.816 -0.629 . . . . 821.44 111.13 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.66 -42.39 83.44 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.97 -0.559 . . . . 746.24 111.744 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.0 1.77 56.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.524 -0.307 . . . . 999.99 111.352 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 57.96 41.65 24.1 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.237 0.615 . . . . 675.44 111.925 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.95 81.63 2.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.935 0.397 . . . . 999.99 110.513 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.2 mt -93.84 118.61 67.36 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.503 . . . . 390.38 110.401 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.82 149.11 53.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.598 2.199 . . . . 243.11 112.717 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.71 135.92 33.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.242 -0.436 . . . . 618.1 110.436 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.73 109.36 3.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.357 . . . . 999.99 111.014 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 89.0 mt -97.23 125.08 46.98 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 415.25 111.237 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 77.2 Cg_exo -55.47 -31.96 80.33 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.277 2.651 . . . . 529.15 113.051 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -62.12 -36.52 81.99 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.371 -0.377 . . . . 516.88 111.091 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 61.1 mtt -60.31 -38.73 84.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.449 -0.341 . . . . 914.6 110.319 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.11 -39.44 89.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.932 -0.576 . . . . 675.31 110.291 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 124' ' ' MET . 97.9 mt-10 -64.03 -40.15 95.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.999 -0.546 . . . . 900.95 110.909 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.6 mt -61.42 -41.79 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.022 0.439 . . . . 300.73 110.45 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASN . . . . . 0.404 ' HA ' ' NH1' ' A' ' 55' ' ' ARG . 99.4 m-20 -60.33 -37.34 80.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 595.29 110.89 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -74.74 -10.85 59.91 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.077 -0.511 . . . . 999.99 112.335 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 65.4 mtt -77.38 119.91 21.66 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.982 -0.287 . . . . 385.68 110.786 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -52.98 120.72 20.34 Favored Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 116.015 -0.538 . . . . 999.99 112.012 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -58.92 -35.83 97.93 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.884 2.39 . . . . 149.6 112.827 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.32 -37.07 85.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.695 0.628 . . . . 147.02 112.695 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -90.84 -22.07 21.16 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.432 0.53 . . . . 360.37 112.432 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 124' ' ' MET . 62.0 t -105.34 109.02 62.73 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 121.028 -0.269 . . . . 187.93 110.774 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.85 138.98 85.99 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.476 2.117 . . . . 265.39 112.463 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.561 HG21 ' HE3' ' A' ' 20' ' ' LYS . 96.6 t -128.54 137.7 56.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.127 -0.488 . . . . 246.78 111.31 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -122.9 147.72 46.27 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.218 -0.66 . . . . 999.99 109.218 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -83.52 125.72 32.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.727 0.298 . . . . 495.41 110.99 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.4 mtm . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.4 -0.81 . . . . 761.34 111.311 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.233 0.221 0 N-CA-C 109.913 -0.403 . . . . 375.52 109.913 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -80.94 119.31 75.68 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.281 -0.418 . . . . 999.99 111.046 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -59.69 144.9 99.34 Favored 'Trans proline' 0 C--N 1.35 0.605 0 C-N-CA 122.973 2.449 . . . . 436.63 111.854 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -120.35 151.42 39.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.822 0.344 . . . . 999.99 111.733 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 63.36 29.17 15.7 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.291 -0.868 . . . . 999.99 112.605 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -57.99 128.22 36.02 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.641 0.258 . . . . 781.6 111.078 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -114.07 114.74 26.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.594 -0.276 . . . . 216.75 110.414 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.76 -39.39 94.0 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.252 -0.431 . . . . 902.9 111.635 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.91 87.6 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.409 -0.359 . . . . 121.35 111.642 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -68.37 -31.37 70.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 265.05 110.398 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.76 -39.91 95.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.909 -0.587 . . . . 524.44 110.679 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.8 t -62.13 -46.81 95.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.013 0.435 . . . . 214.56 110.86 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.57 93.99 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.626 -0.715 . . . . 61.91 110.596 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 85' ' ' TYR . 65.1 tp -64.27 -45.28 88.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.602 -0.726 . . . . 321.59 111.883 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -61.77 -40.75 96.27 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.259 0.837 . . . . 491.97 113.259 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.65 -33.76 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.221 -0.591 . . . . 179.68 111.485 -179.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.05 -40.67 78.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.047 0.451 . . . . 483.12 109.898 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.15 -43.29 95.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 115.442 -0.799 . . . . 120.91 110.64 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -60.88 -43.27 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.839 -0.619 . . . . 324.41 111.276 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -43.32 98.49 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.618 0.229 . . . . 76.38 111.618 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.24 -42.28 97.95 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.881 -0.676 . . . . 59.56 112.733 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -74.7 -18.29 60.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.8 0.333 . . . . 169.43 111.505 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -75.73 -31.79 59.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.344 -0.389 . . . . 145.09 110.912 -178.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -60.76 -46.08 91.83 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.465 -0.569 . . . . 779.77 109.465 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.98 93.56 Favored Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.605 -0.725 . . . . 72.33 111.751 178.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.87 -48.27 82.59 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.428 -0.386 . . . . 213.67 111.655 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.89 -29.45 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 C-N-CA 120.929 -0.308 . . . . 275.82 111.214 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.528 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 64.2 tttm -62.41 -43.78 98.0 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.967 0.413 . . . . 545.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.792 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 27.5 t90 -70.22 -39.51 75.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.16 -0.473 . . . . 999.99 110.18 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.29 -38.42 91.09 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.619 0.6 . . . . 205.93 112.619 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -66.32 -19.17 65.74 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.885 -0.509 . . . . 557.46 111.431 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.11 -52.56 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 112.551 0.575 . . . . 284.57 112.551 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -111.6 -8.08 14.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.951 0.723 . . . . 350.44 112.951 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.64 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -67.82 -17.82 69.76 Favored Glycine 0 N--CA 1.46 0.241 0 C-N-CA 121.252 -0.499 . . . . 199.7 113.567 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -61.18 -39.37 89.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.752 0.31 . . . . 999.99 111.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -91.6 -8.22 47.92 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.688 0.625 . . . . 302.8 112.688 -179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.792 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 96.1 mt -72.8 141.86 48.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.884 0.373 . . . . 581.97 111.509 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.9 p -77.59 168.44 19.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.068 -0.514 . . . . 239.07 110.375 178.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 87.0 m -60.9 -40.44 93.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.881 0.372 . . . . 192.01 110.713 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.679 HG13 ' HB2' ' A' ' 114' ' ' TYR . 61.8 t -65.6 -44.28 93.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.004 -0.543 . . . . 278.45 110.946 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -63.99 -41.57 97.47 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.422 -0.354 . . . . 316.42 111.232 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -62.89 -46.32 88.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.458 -0.337 . . . . 470.35 110.825 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -65.09 -40.72 94.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.118 -0.492 . . . . 369.78 110.909 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.19 78.95 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.859 -0.61 . . . . 66.79 111.499 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.01 -39.18 81.09 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.043 -0.526 . . . . 238.3 111.327 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -60.77 -40.17 91.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.701 0.286 . . . . 526.93 110.527 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.506 ' HB2' ' SD ' ' A' ' 118' ' ' MET . 61.4 t80 -66.39 -39.75 89.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.219 -0.446 . . . . 162.88 109.887 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.7 t -60.99 -43.86 96.95 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.712 -0.676 . . . . 139.01 110.025 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.68 -40.4 91.99 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.903 -0.59 . . . . 198.61 109.98 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' MET . 77.4 ttt-85 -60.35 -47.91 84.01 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.808 -0.633 . . . . 999.99 110.757 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.4 mmm-85 -64.59 -40.77 96.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.098 0.475 . . . . 799.65 110.793 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -62.51 -48.16 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.663 -0.698 . . . . 151.58 112.48 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.499 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 4.9 ppp? -64.36 -38.37 90.79 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.172 0.804 . . . . 168.43 113.172 -178.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.41 -39.14 71.3 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.482 -0.487 . . . . 530.56 111.78 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.6 p -73.82 -41.33 62.47 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 111.72 0.267 . . . . 293.49 111.72 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -63.76 -45.87 87.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.834 0.35 . . . . 383.72 110.427 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.456 ' CZ2' HD21 ' A' ' 19' ' ' LEU . 74.9 t-105 -62.38 -47.56 83.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.896 -0.593 . . . . 497.0 111.729 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.73 88.33 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.502 -0.317 . . . . 177.0 111.709 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -61.41 -46.87 88.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.838 0.351 . . . . 478.76 110.709 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.51 -46.7 84.85 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 727.09 110.865 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.5 mmm -52.04 -19.66 2.0 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.183 1.179 . . . . 664.46 114.183 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.0 mt -59.77 -43.59 94.27 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 118.257 0.481 . . . . 447.74 110.587 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -68.43 -45.54 72.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.03 -0.532 . . . . 999.99 111.271 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.0 mm -67.95 -41.11 84.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 115.465 -0.789 . . . . 398.95 112.787 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -59.2 -39.15 81.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.052 0.39 . . . . 366.97 112.052 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.83 -42.28 97.42 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 121.042 -0.263 . . . . 709.01 110.955 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.29 -42.06 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.528 -0.306 . . . . 931.14 111.64 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.67 -47.99 88.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.53 -0.305 . . . . 175.26 111.291 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.31 -40.32 97.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.219 -0.446 . . . . 443.19 111.504 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.31 -40.74 96.54 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.495 -0.32 . . . . 366.44 111.51 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.26 -40.28 77.92 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.817 0.341 . . . . 386.93 111.279 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.05 -8.48 79.75 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.978 -0.63 . . . . 244.67 112.776 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.6 mmt180 -74.57 145.63 43.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.61 0.243 . . . . 999.99 111.063 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 79.8 p -72.14 138.12 81.77 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.436 -0.347 . . . . 263.29 110.845 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 36.1 Cg_exo -61.51 135.36 56.62 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.537 2.158 . . . . 173.89 112.842 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.632 HG13 ' H ' ' A' ' 84' ' ' ASP . 12.2 p -104.07 150.58 7.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.467 -0.333 . . . . 201.66 110.235 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.93 -42.07 95.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 111.974 0.361 . . . . 81.09 111.974 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.23 -43.13 97.42 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 120.906 -0.664 . . . . 106.63 113.546 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.632 ' H ' HG13 ' A' ' 81' ' ' VAL . 36.9 t70 -63.89 -43.02 97.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.03 0.443 . . . . 397.23 110.435 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD13 ' A' ' 19' ' ' LEU . 3.9 m-30 -64.42 -41.12 96.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.545 -0.752 . . . . 176.41 111.774 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.5 p -67.91 -36.19 79.76 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 121.011 -0.276 . . . . 224.32 111.306 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -62.61 -45.99 90.34 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.223 0.535 . . . . 999.99 109.639 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.72 -39.8 91.54 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.42 -0.809 . . . . 158.17 110.53 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.67 -39.71 97.78 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.633 -0.712 . . . . 65.71 112.771 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.71 94.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.651 0.262 . . . . 95.38 110.971 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -65.54 -40.65 93.12 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.144 0.497 . . . . 381.14 110.522 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.2 mm -65.52 -41.79 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.461 -0.791 . . . . 182.12 111.21 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.41 -16.96 61.32 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.899 -0.592 . . . . 88.8 113.707 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -79.78 -13.92 59.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 117.034 0.417 . . . . 999.99 111.362 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -108.58 119.81 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.772 0.32 . . . . 999.99 110.433 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.2 pt -129.82 156.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 308.67 111.483 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -136.21 21.62 3.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.344 0.592 . . . . 388.05 109.974 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.5 mtp -64.54 -39.48 93.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.324 -0.853 . . . . 360.57 112.23 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.98 -40.88 97.11 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.246 0.461 . . . . 184.23 112.246 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -78.5 -21.6 48.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.594 -0.275 . . . . 999.99 111.687 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.481 ' CE2' HD11 ' A' ' 105' ' ' LEU . 88.3 t80 -59.46 -46.76 87.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.474 -0.33 . . . . 374.13 111.013 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -62.0 -39.44 92.24 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.697 0.284 . . . . 999.99 110.902 179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -62.59 -42.72 99.73 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.112 -0.495 . . . . 558.87 110.23 179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.23 -40.24 95.47 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.802 -0.635 . . . . 332.85 111.092 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.55 -42.12 99.34 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.355 -0.384 . . . . 472.21 110.835 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.66 -44.0 97.37 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.279 -0.419 . . . . 821.44 110.976 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.89 -39.92 82.85 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.032 -0.531 . . . . 746.24 111.935 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.17 -2.23 56.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.527 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.2 t30 56.66 43.71 24.99 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 123.64 0.588 . . . . 675.44 111.299 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 78.9 mtm -103.85 111.16 23.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.368 . . . . 999.99 111.371 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 72.3 mt -94.67 118.92 66.79 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 390.38 109.996 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.83 118.88 5.77 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.159 1.906 . . . . 243.11 112.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.75 142.88 28.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 618.1 110.623 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.679 ' HB2' HG13 ' A' ' 45' ' ' VAL . 86.9 t80 -67.36 125.78 27.18 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.721 0.296 . . . . 999.99 110.906 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.2 mt -99.53 144.7 28.78 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.269 -0.423 . . . . 415.25 110.87 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.25 -18.89 50.72 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.667 2.245 . . . . 529.15 112.056 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -62.61 -26.67 68.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.475 -0.784 . . . . 516.88 111.358 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 52' ' ' PHE . 93.9 mmm -59.88 -38.92 83.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.256 -0.429 . . . . 914.6 111.529 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.88 -40.87 94.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.573 -0.285 . . . . 675.31 110.73 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -65.35 -40.98 94.3 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.429 -0.35 . . . . 900.95 111.181 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 28.6 mm -61.91 -45.02 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.384 -0.371 . . . . 300.73 111.08 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.12 -39.69 95.43 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.024 0.379 . . . . 595.29 112.024 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -70.19 -33.18 71.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.7 mtm -88.06 132.93 34.1 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.535 0.569 . . . . 385.68 112.535 -178.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.9 mmt180 -53.77 145.54 30.68 Favored Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.586 -0.734 . . . . 999.99 110.874 178.093 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.61 -30.06 90.97 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.671 2.247 . . . . 149.6 112.884 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.73 -36.03 81.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.233 -0.439 . . . . 147.02 111.234 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -91.98 0.48 57.47 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.552 0.575 . . . . 360.37 112.552 -178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 66.3 t -83.13 116.6 65.15 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 187.93 110.964 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.56 156.34 49.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.821 2.348 . . . . 265.39 112.696 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 m -129.61 159.93 41.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.13 -0.486 . . . . 246.78 110.564 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -118.12 136.04 53.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.976 0.417 . . . . 999.99 111.521 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.3 165.64 18.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 495.41 110.349 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 3.4 mtt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.158 -0.925 . . . . 761.34 111.082 -179.285 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.0 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.815 0.341 . . . . 375.52 110.809 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -90.2 120.39 69.17 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 999.99 110.341 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.28 147.73 53.85 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.661 2.241 . . . . 436.63 112.906 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -157.16 -25.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.047 -0.524 . . . . 999.99 111.579 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -87.19 -12.63 46.3 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.288 0.477 . . . . 999.99 112.288 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.63 139.25 54.09 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.099 0.476 . . . . 781.6 112.036 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -100.52 123.57 44.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.771 -0.65 . . . . 216.75 110.008 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.45 -38.82 88.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.466 . . . . 902.9 111.282 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.77 86.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.404 -0.362 . . . . 121.35 111.562 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -68.51 -32.7 72.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 265.05 110.061 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -64.47 -38.62 91.65 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.8 -0.637 . . . . 524.44 110.018 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.71 -45.12 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 115.663 -0.699 . . . . 214.56 110.724 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.11 94.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 61.91 110.68 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.564 HD21 ' HB3' ' A' ' 85' ' ' TYR . 84.8 mt -65.81 -38.59 89.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.899 -0.591 . . . . 321.59 111.566 178.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -60.61 -38.19 83.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.207 -0.452 . . . . 491.97 111.695 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.95 -43.6 99.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 179.68 110.43 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.76 -41.48 97.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.208 -0.451 . . . . 483.12 110.767 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.41 -43.54 97.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.876 -0.602 . . . . 120.91 110.88 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.32 -40.81 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.726 -0.67 . . . . 324.41 111.64 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.85 -43.32 94.69 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.631 0.234 . . . . 76.38 111.631 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.41 -42.62 97.56 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.677 -0.773 . . . . 59.56 112.537 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -72.41 -19.91 61.52 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 111.97 0.359 . . . . 169.43 111.97 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -31.96 58.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.612 -0.267 . . . . 145.09 111.263 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 41.0 mmt180 -61.57 -42.48 98.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.894 0.378 . . . . 779.77 110.176 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.17 70.18 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.992 -0.549 . . . . 72.33 112.195 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -60.71 -46.27 91.03 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.341 0.497 . . . . 213.67 112.341 -178.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.1 m -68.72 -26.68 33.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 112.37 0.507 . . . . 275.82 112.37 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 48.5 mmtm -63.6 -43.12 97.84 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.711 0.291 . . . . 545.0 111.072 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.453 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 86.2 m95 -81.14 -28.06 35.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.732 0.301 . . . . 999.99 111.128 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.84 -43.87 97.7 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.851 -0.613 . . . . 205.93 111.537 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -70.89 -20.87 62.46 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.822 0.304 . . . . 557.46 111.822 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.8 t -87.59 -49.75 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.498 0.555 . . . . 284.57 112.498 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.47 8.75 41.93 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.449 0.537 . . . . 350.44 112.449 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.86 -38.9 96.08 Favored Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.333 -0.461 . . . . 199.7 113.719 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.7 ptm180 -64.43 -23.65 67.36 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.493 0.553 . . . . 999.99 112.493 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.529 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.5 p -112.36 1.99 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.085 0.402 . . . . 302.8 112.085 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.0 tp -72.52 124.4 25.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.348 . . . . 581.97 111.21 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.6 m -77.93 156.36 30.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 239.07 110.858 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.4 m -61.08 -42.84 99.24 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.376 -0.375 . . . . 192.01 111.013 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.592 HG13 ' HB2' ' A' ' 114' ' ' TYR . 66.7 t -66.09 -42.07 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 116.166 -0.47 . . . . 278.45 110.597 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -62.98 -40.52 97.98 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.066 -0.516 . . . . 316.42 111.222 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.76 -47.71 85.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.43 -0.35 . . . . 470.35 110.995 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.24 -40.8 90.48 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.879 0.371 . . . . 369.78 110.953 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.63 93.91 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.796 -0.638 . . . . 66.79 111.881 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.3 -39.54 83.34 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.225 -0.443 . . . . 238.3 112.12 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -62.75 -43.4 98.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.884 -0.326 . . . . 526.93 110.232 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.62 -48.23 80.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.956 -0.565 . . . . 162.88 110.526 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.417 HG11 ' CZ ' ' A' ' 101' ' ' PHE . 69.2 t -61.76 -42.19 93.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-N 115.52 -0.764 . . . . 139.01 111.408 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -58.89 -45.77 89.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.688 -0.233 . . . . 198.61 111.456 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 89.0 mtm180 -65.1 -42.13 94.33 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.943 -0.303 . . . . 999.99 111.211 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.97 -40.94 95.75 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.214 0.531 . . . . 799.65 110.57 178.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -61.21 -46.3 91.02 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.295 -0.866 . . . . 151.58 110.415 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 42.3 ttp -60.43 -40.07 89.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.617 -0.719 . . . . 168.43 110.998 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 76.6 mt-30 -61.99 -39.79 93.44 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 112.584 0.587 . . . . 530.56 112.584 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 74.1 p -65.51 -41.74 92.84 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.681 -0.408 . . . . 293.49 111.584 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 77.9 m-70 -71.06 -40.14 71.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.859 0.362 . . . . 383.72 110.775 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' A' ' 66' ' ' MET . 69.3 t-105 -62.12 -46.02 90.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.882 -0.599 . . . . 497.0 110.944 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -39.91 83.56 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.22 -0.445 . . . . 177.0 111.567 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -60.6 -45.4 94.13 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.269 -0.423 . . . . 478.76 111.005 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 57.1 m-85 -68.45 -39.29 81.52 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.269 -0.423 . . . . 727.09 111.199 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' TRP . 92.9 mmm -55.24 -41.17 71.76 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.413 0.523 . . . . 664.46 112.413 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.72 -47.71 84.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.826 0.346 . . . . 447.74 110.473 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.2 t90 -64.96 -45.94 83.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.071 -0.513 . . . . 999.99 110.828 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.6 -46.82 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.734 -0.666 . . . . 398.95 111.89 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -61.86 -40.97 97.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.831 -0.168 . . . . 366.97 111.435 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -62.45 -45.88 91.06 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.442 -0.345 . . . . 709.01 110.657 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -62.11 -46.55 88.53 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.019 -0.537 . . . . 931.14 111.075 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.93 -44.25 99.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.1 -0.5 . . . . 175.26 111.118 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -60.43 -44.18 96.05 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.344 -0.389 . . . . 443.19 111.222 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.48 97.17 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.492 -0.322 . . . . 366.44 111.476 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.01 -40.34 75.31 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.364 -0.38 . . . . 386.93 111.494 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.61 -4.91 85.08 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 116.068 -0.515 . . . . 244.67 112.351 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -75.6 154.71 36.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 999.99 111.435 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.7 p -110.44 95.68 23.67 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 263.29 110.394 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.77 151.89 57.93 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.799 2.333 . . . . 173.89 113.703 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.6 m -100.79 -176.5 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.605 -0.725 . . . . 201.66 110.863 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.428 ' O ' HG23 ' A' ' 86' ' ' THR . 70.9 t -60.03 -42.24 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.384 -0.371 . . . . 81.09 111.01 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.05 96.12 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.848 -0.692 . . . . 106.63 112.814 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.52 -41.89 96.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.078 0.466 . . . . 397.23 110.348 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 19' ' ' LEU . 38.0 m-85 -67.14 -37.56 84.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.611 -0.722 . . . . 176.41 112.032 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 82' ' ' VAL . 70.3 p -64.96 -28.54 69.59 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.376 0.51 . . . . 224.32 112.376 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.3 ttp-105 -61.85 -46.35 89.81 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.579 -0.526 . . . . 999.99 109.579 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.83 -40.08 83.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.545 -0.752 . . . . 158.17 110.393 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.78 98.22 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.605 -0.725 . . . . 65.71 112.902 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.15 -40.61 94.5 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.543 0.211 . . . . 95.38 111.097 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.76 -40.23 94.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.271 -0.422 . . . . 381.14 110.408 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.69 -43.64 98.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.854 -0.612 . . . . 182.12 110.558 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.97 -21.21 65.43 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.884 -0.598 . . . . 88.8 113.447 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 85.7 mtp180 -80.14 -17.04 53.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.892 0.346 . . . . 999.99 111.196 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -109.2 112.73 25.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 999.99 110.725 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.3 pt -130.3 156.22 42.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.877 0.37 . . . . 308.67 111.079 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -141.01 34.12 1.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.247 0.546 . . . . 388.05 110.094 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 99.2 mtp -66.77 -34.26 77.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.427 -0.806 . . . . 360.57 111.578 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . 0.453 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -59.6 -38.32 80.95 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.253 -0.431 . . . . 184.23 110.941 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.1 -42.0 93.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.636 -0.711 . . . . 999.99 110.59 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.417 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 85.4 t80 -58.02 -47.33 83.39 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.967 -0.56 . . . . 374.13 111.505 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -60.41 -42.9 96.95 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.625 0.25 . . . . 999.99 110.939 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.69 -45.47 78.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.292 -0.413 . . . . 558.87 110.956 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.22 -40.18 96.73 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.866 -0.606 . . . . 332.85 112.088 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.59 -49.4 77.67 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.516 -0.311 . . . . 472.21 110.705 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -63.7 -39.27 93.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.814 0.34 . . . . 821.44 111.093 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.96 -39.88 79.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.921 -0.582 . . . . 746.24 111.817 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -82.55 -11.29 58.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.896 0.332 . . . . 999.99 111.896 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 53.51 43.03 31.81 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.394 0.434 . . . . 675.44 111.79 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -118.27 121.61 40.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.746 0.308 . . . . 999.99 110.52 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.3 mt -94.66 116.42 66.37 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.421 -0.354 . . . . 390.38 110.226 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.56 136.41 71.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.651 2.234 . . . . 243.11 112.617 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -85.46 134.42 34.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 618.1 110.579 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.592 ' HB2' HG13 ' A' ' 45' ' ' VAL . 72.8 t80 -68.24 116.99 9.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.795 0.331 . . . . 999.99 110.551 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.9 mt -99.38 147.67 33.64 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.404 . . . . 415.25 110.772 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.03 -28.61 66.0 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.542 2.161 . . . . 529.15 112.098 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.23 -37.91 89.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.861 -0.609 . . . . 516.88 110.813 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.0 mtt -59.6 -42.05 91.69 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-N 116.049 -0.523 . . . . 914.6 110.4 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -61.81 -44.72 96.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.125 -0.489 . . . . 675.31 110.817 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.63 -45.05 88.49 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.899 -0.592 . . . . 900.95 112.462 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.421 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 17.8 tt -72.91 -25.18 21.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 120.735 0.302 . . . . 300.73 111.719 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.13 -37.99 87.24 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.97 0.414 . . . . 595.29 111.139 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -85.44 -0.7 55.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 999.99 111.785 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 121' ' ' ILE . 99.0 mtp -90.15 125.66 35.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.606 0.241 . . . . 385.68 111.291 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.507 ' O ' HG23 ' A' ' 129' ' ' VAL . 99.5 mtt180 -53.19 141.48 40.63 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-N 115.982 -0.554 . . . . 999.99 111.035 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.56 -36.63 81.2 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.982 2.454 . . . . 149.6 112.715 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.6 -34.86 76.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.923 -0.58 . . . . 147.02 111.781 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.85 0.27 57.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.229 0.455 . . . . 360.37 112.229 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.3 t -85.57 117.02 67.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.749 0.309 . . . . 187.93 110.624 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.35 155.58 55.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.573 2.182 . . . . 265.39 112.889 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.5 t -113.77 136.86 48.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 246.78 109.843 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -115.49 131.49 56.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.85 0.357 . . . . 999.99 111.317 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -81.35 152.23 27.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 495.41 110.565 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.7 mtp . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.22 -0.895 . . . . 761.34 110.667 -179.699 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.9 t . . . . . 0 C--O 1.233 0.216 0 N-CA-C 109.653 -0.499 . . . . 375.52 109.653 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 46.3 mp0 -80.21 121.33 81.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 999.99 110.77 -178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 47.8 Cg_exo -60.23 141.91 97.03 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.002 2.468 . . . . 436.63 112.709 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -74.36 143.94 44.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.511 . . . . 999.99 110.295 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -91.23 102.91 15.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.936 0.398 . . . . 999.99 110.718 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.0 mp -57.82 149.66 21.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.638 -0.71 . . . . 781.6 111.509 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -65.2 145.73 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.877 -0.416 . . . . 216.75 109.877 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.25 -45.14 91.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.615 -0.266 . . . . 902.9 111.187 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.35 88.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.5 -0.318 . . . . 121.35 111.615 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -67.89 -35.22 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 265.05 110.213 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 95.8 mt-10 -65.18 -38.9 91.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.822 -0.626 . . . . 524.44 110.161 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.1 -45.6 95.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.823 -0.626 . . . . 214.56 111.104 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.12 98.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.898 -0.592 . . . . 61.91 111.001 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.5 mt -69.05 -38.85 79.35 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.939 -0.573 . . . . 321.59 111.948 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 62.4 mtpt -60.74 -39.37 88.43 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.39 0.515 . . . . 491.97 112.39 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.81 -44.66 99.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.709 0.29 . . . . 179.68 110.841 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.96 -40.29 91.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.415 -0.357 . . . . 483.12 111.335 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.88 -45.05 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 120.918 0.39 . . . . 120.91 110.829 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.96 -42.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 115.886 -0.597 . . . . 324.41 111.323 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.32 95.72 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 121.115 -0.234 . . . . 76.38 111.138 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.72 -42.6 95.2 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.81 -0.71 . . . . 59.56 112.653 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -71.61 -19.61 62.09 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.626 0.37 . . . . 169.43 111.916 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.39 -29.01 56.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.828 -0.169 . . . . 145.09 110.887 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.59 -40.56 97.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 779.77 110.56 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.21 -29.53 40.7 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.703 -0.76 . . . . 72.33 112.492 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.5 -43.13 95.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.927 0.343 . . . . 213.67 111.927 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.448 ' HA ' HD12 ' A' ' 35' ' ' LEU . 26.8 m -64.72 -26.09 39.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 112.388 0.514 . . . . 275.82 112.388 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.84 -43.12 99.49 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.551 0.215 . . . . 545.0 110.85 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -72.2 -35.78 69.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.061 0.457 . . . . 999.99 110.439 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 32' ' ' VAL . 93.0 mt -62.91 -38.43 90.91 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.524 -0.762 . . . . 205.93 111.555 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -68.88 -24.02 64.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.661 0.245 . . . . 557.46 111.661 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.6 t -85.75 -46.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 112.233 0.457 . . . . 284.57 112.233 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -101.29 8.51 42.4 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.421 0.526 . . . . 350.44 112.421 -178.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.48 -26.54 69.72 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 121.483 -0.389 . . . . 199.7 113.827 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -61.61 -40.2 93.97 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.772 0.286 . . . . 999.99 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.0 p -112.96 14.18 19.65 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.037 0.384 . . . . 302.8 112.037 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.4 tp -71.12 123.53 22.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.983 0.42 . . . . 581.97 111.515 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.4 m -79.59 159.98 26.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.966 -0.561 . . . . 239.07 110.865 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.7 m -60.92 -44.98 96.44 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.335 -0.393 . . . . 192.01 111.456 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 45' ' ' VAL . 1.3 m -71.03 -29.44 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 112.256 0.465 . . . . 278.45 112.256 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.69 -40.08 94.77 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 121.216 -0.194 . . . . 316.42 110.987 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.475 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.9 tttp -61.38 -46.68 89.19 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.86 0.362 . . . . 470.35 110.136 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.953 -0.567 . . . . 369.78 110.649 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.54 90.52 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 115.848 -0.615 . . . . 66.79 110.755 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.05 -39.12 93.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.084 -0.507 . . . . 238.3 111.336 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.475 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 43.4 m-85 -63.18 -38.94 93.17 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 109.249 -0.648 . . . . 526.93 109.249 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -61.09 -47.57 85.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.454 -0.793 . . . . 162.88 109.678 177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.5 t -62.86 -41.94 94.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 115.991 -0.55 . . . . 139.01 110.288 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -59.43 -43.1 93.14 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.949 -0.569 . . . . 198.61 111.053 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HG2' HE21 ' A' ' 59' ' ' GLN . 48.2 ttp180 -61.04 -46.97 88.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.824 0.345 . . . . 999.99 110.508 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -62.74 -44.57 95.86 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.974 -0.557 . . . . 799.65 110.464 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.22 -48.11 83.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.505 -0.77 . . . . 151.58 111.232 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 43.9 ttp -60.74 -45.67 93.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.202 -0.453 . . . . 168.43 111.379 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.411 HE21 ' HG2' ' A' ' 55' ' ' ARG . 75.3 mt-30 -64.82 -41.12 96.02 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.062 -0.255 . . . . 530.56 111.063 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -63.68 -45.94 87.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.374 -0.375 . . . . 293.49 110.693 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -62.55 -46.28 89.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.894 -0.594 . . . . 383.72 110.132 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -61.51 -47.76 84.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.818 -0.628 . . . . 497.0 111.304 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.93 93.57 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.419 0.525 . . . . 177.0 112.419 -179.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -63.69 -43.38 96.79 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.187 -0.301 . . . . 478.76 110.187 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -65.44 -44.26 87.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.185 -0.461 . . . . 727.09 110.185 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 tpt -53.53 -45.35 69.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.428 -0.805 . . . . 664.46 111.806 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.2 mp -60.88 -40.92 94.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.657 0.243 . . . . 447.74 111.657 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -63.04 -47.2 84.04 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.398 -0.364 . . . . 999.99 111.758 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 44.8 pt -77.44 -23.05 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.259 0.466 . . . . 398.95 112.259 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -58.99 -39.24 81.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.464 -0.335 . . . . 366.97 111.414 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.99 -43.26 99.12 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.665 0.269 . . . . 709.01 110.753 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -66.0 -45.08 82.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.255 -0.429 . . . . 931.14 110.758 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 37.8 mm -62.85 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.816 -0.629 . . . . 175.26 111.327 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -62.04 -43.61 98.46 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.31 -0.404 . . . . 443.19 111.368 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.45 97.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.498 -0.319 . . . . 366.44 111.462 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.15 -40.67 78.07 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.894 0.378 . . . . 386.93 111.168 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.91 -9.77 75.29 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.053 -0.521 . . . . 244.67 112.675 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -75.26 147.79 39.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.377 . . . . 999.99 111.338 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 12.1 p -102.02 106.3 46.92 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 263.29 110.51 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.11 145.4 49.33 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.628 2.219 . . . . 173.89 113.473 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.7 m -101.66 -175.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 201.66 111.236 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.61 -40.58 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.333 -0.394 . . . . 81.09 110.81 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.631 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.09 -40.29 96.92 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.889 -0.672 . . . . 106.63 112.641 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.9 -42.66 80.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.086 0.469 . . . . 397.23 110.612 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -68.2 -35.49 78.07 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.856 -0.611 . . . . 176.41 112.236 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.631 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -59.8 -34.64 73.3 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.453 0.168 . . . . 224.32 111.453 -179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.98 -41.16 95.67 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.062 0.458 . . . . 999.99 109.898 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.22 -39.81 78.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.494 -0.776 . . . . 158.17 110.265 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -39.52 97.69 Favored Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.421 -0.809 . . . . 65.71 112.535 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.18 92.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.596 0.236 . . . . 95.38 110.67 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -64.78 -40.43 95.24 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.102 -0.499 . . . . 381.14 110.25 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.65 -43.24 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.639 -0.71 . . . . 182.12 110.589 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.72 -22.37 64.07 Favored Glycine 0 CA--C 1.52 0.394 0 CA-C-N 115.895 -0.593 . . . . 88.8 113.429 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.5 mmt-85 -80.08 -18.56 49.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.896 0.348 . . . . 999.99 111.191 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.1 mmt85 -108.47 111.98 24.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 999.99 110.379 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 60.4 mt -124.66 126.17 71.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.844 -0.428 . . . . 308.67 109.844 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.35 32.23 5.71 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.971 -0.292 . . . . 388.05 111.633 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 77.7 mtm -70.0 -28.73 65.74 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.556 -0.293 . . . . 360.57 111.039 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.79 -37.96 80.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.016 -0.538 . . . . 184.23 110.777 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -59.83 -42.21 93.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.665 -0.698 . . . . 999.99 110.368 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.94 -46.78 84.53 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.821 -0.627 . . . . 374.13 111.12 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -60.12 -44.37 94.95 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.536 0.208 . . . . 999.99 110.799 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.21 -42.74 93.18 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.455 -0.339 . . . . 558.87 111.126 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.85 96.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.063 -0.517 . . . . 332.85 111.574 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.97 -46.22 90.21 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.887 -0.597 . . . . 472.21 110.852 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.73 -39.31 93.98 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.307 -0.406 . . . . 821.44 111.352 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.73 -38.91 79.41 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.196 -0.456 . . . . 746.24 111.879 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -83.09 -11.65 57.8 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.601 -0.272 . . . . 999.99 111.385 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 54.98 39.89 31.8 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.563 0.539 . . . . 675.44 111.615 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.2 ttp -107.72 124.0 49.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.337 -0.392 . . . . 999.99 110.874 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.3 mt -94.11 117.12 67.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.378 -0.374 . . . . 390.38 110.373 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -59.78 142.02 97.89 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.821 2.347 . . . . 243.11 112.421 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -84.79 119.49 25.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 618.1 110.403 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -70.07 116.5 10.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.058 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.702 ' O ' ' HG2' ' A' ' 118' ' ' MET . 3.4 mm? -99.04 129.96 28.45 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.488 . . . . 415.25 111.243 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.1 Cg_exo -58.5 -31.9 95.3 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.733 2.289 . . . . 529.15 112.565 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -61.22 -40.89 95.68 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.931 0.715 . . . . 516.88 112.931 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' MET . . . . . 0.702 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 24.8 ptt? -55.39 -22.46 19.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.551 0.575 . . . . 914.6 112.551 -178.015 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.13 -39.09 88.7 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.144 0.497 . . . . 675.31 110.337 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -67.75 -37.23 81.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.755 -0.657 . . . . 900.95 111.147 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.2 mt -60.34 -46.25 95.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.761 0.652 . . . . 300.73 112.761 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -80.46 -9.84 59.75 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.208 -0.597 . . . . 595.29 111.232 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -87.98 -32.77 18.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.822 0.344 . . . . 999.99 110.923 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 ptp -77.7 148.32 35.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.032 0.444 . . . . 385.68 111.855 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 125' ' ' ARG . 42.5 ttm105 -51.96 128.69 37.96 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-N 115.371 -0.831 . . . . 999.99 111.572 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.19 -35.32 90.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.096 2.531 . . . . 149.6 112.895 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.13 -24.14 67.76 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.119 -0.491 . . . . 147.02 112.117 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.73 -0.93 57.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.622 -0.263 . . . . 360.37 111.563 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.2 t -88.0 119.23 70.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.688 0.28 . . . . 187.93 110.829 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.17 156.98 58.52 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.826 2.351 . . . . 265.39 112.749 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.408 HG13 ' HG2' ' A' ' 59' ' ' GLN . 93.9 t -118.73 137.45 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.057 -0.52 . . . . 246.78 110.53 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -114.57 129.79 56.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.505 -0.316 . . . . 999.99 110.425 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -82.69 75.28 9.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.938 0.399 . . . . 495.41 110.91 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.5 mtm . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.25 -0.881 . . . . 761.34 110.995 179.767 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.751 0.31 . . . . 375.52 110.659 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -81.15 156.97 71.52 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.447 . . . . 999.99 110.829 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.78 139.76 90.04 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.639 2.226 . . . . 436.63 111.933 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -121.86 -51.26 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.868 0.322 . . . . 999.99 111.868 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -101.02 3.22 41.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.81 0.3 . . . . 999.99 111.81 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 11' ' ' LEU . 1.8 mm? -57.97 113.62 1.97 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.826 0.346 . . . . 781.6 111.492 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -114.24 152.07 31.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 216.75 110.969 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.34 -41.72 97.51 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.218 -0.446 . . . . 902.9 110.557 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.56 -38.79 82.06 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.932 -0.576 . . . . 121.35 111.405 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -63.08 -37.98 89.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 265.05 109.876 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.21 -44.07 96.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.855 -0.611 . . . . 524.44 110.271 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.89 -45.81 97.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.609 -0.723 . . . . 214.56 111.242 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.19 90.63 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.058 -0.519 . . . . 61.91 111.164 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 85' ' ' TYR . 76.1 mt -62.02 -42.37 99.09 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.35 -0.386 . . . . 321.59 110.715 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' O ' HG12 ' A' ' 24' ' ' ILE . 31.7 mmmt -61.98 -39.81 93.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.383 -0.371 . . . . 491.97 111.353 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 76.4 t -64.0 -46.64 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.669 -0.241 . . . . 179.68 110.994 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -68.41 -42.72 78.56 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.907 0.384 . . . . 483.12 111.034 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.444 HD13 ' SD ' ' A' ' 58' ' ' MET . 83.6 mt -63.8 -46.73 93.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.728 -0.669 . . . . 120.91 112.432 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 20' ' ' LYS . 30.1 mm -61.02 -45.98 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 121.044 -0.263 . . . . 324.41 111.058 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.51 92.28 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.768 0.285 . . . . 76.38 111.768 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.52 -45.25 90.78 Favored Glycine 0 C--N 1.335 0.521 0 C-N-CA 120.938 -0.649 . . . . 59.56 113.683 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CD1' HG23 ' A' ' 23' ' ' ILE . 46.6 m-85 -73.2 -20.79 60.8 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.017 0.377 . . . . 169.43 112.017 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.0 t70 -75.9 -38.14 58.07 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.827 -0.17 . . . . 145.09 111.17 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 tpp85 -60.56 -45.82 92.49 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.833 -0.432 . . . . 779.77 109.833 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.427 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.47 -40.09 98.2 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.761 -0.654 . . . . 72.33 112.387 178.528 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.33 -39.46 94.61 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.573 0.225 . . . . 213.67 111.122 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 28' ' ' ASP . 57.6 t -59.8 -40.09 81.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.137 -0.483 . . . . 275.82 111.76 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.17 -41.6 93.17 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 111.653 0.242 . . . . 545.0 111.653 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.427 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 7.3 m-90 -80.74 -36.95 31.37 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.687 0.28 . . . . 999.99 111.49 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.8 mt -64.74 -38.37 90.75 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.536 0.569 . . . . 205.93 112.536 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -64.13 -18.82 64.8 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.449 0.537 . . . . 557.46 112.449 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.1 t -84.71 -42.92 17.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.741 0.305 . . . . 284.57 111.699 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -104.25 11.96 34.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.753 0.311 . . . . 350.44 111.555 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.18 -20.14 68.87 Favored Glycine 0 CA--C 1.517 0.195 0 CA-C-N 116.049 -0.523 . . . . 199.7 114.359 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -61.31 -40.84 95.67 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.038 0.419 . . . . 999.99 111.662 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.6 p -113.4 9.99 18.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.911 0.338 . . . . 302.8 111.911 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.6 tp -71.75 123.35 22.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.986 0.422 . . . . 581.97 111.946 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.5 m -79.77 157.93 26.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 239.07 110.454 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 94.2 m -60.93 -44.36 97.34 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.803 0.335 . . . . 192.01 111.183 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.39 -31.75 52.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.263 -0.426 . . . . 278.45 112.068 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.92 -41.97 90.7 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.867 0.365 . . . . 316.42 110.282 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.493 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.7 tttp -62.86 -46.42 87.95 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.808 -0.633 . . . . 470.35 110.229 178.604 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.18 -40.72 98.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.395 -0.821 . . . . 369.78 111.252 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.37 95.71 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.169 -0.469 . . . . 66.79 111.626 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.25 -39.11 93.28 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.29 -0.414 . . . . 238.3 112.0 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.493 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 36.3 m-85 -63.5 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.829 -0.434 . . . . 526.93 109.829 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -62.27 -47.14 85.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.622 -0.717 . . . . 162.88 111.341 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.25 -26.81 23.04 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 C-N-CA 120.5 -0.48 . . . . 139.01 111.366 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.12 -44.36 96.81 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.859 0.362 . . . . 198.61 110.307 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtm-85 -64.99 -38.64 91.62 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.875 -0.602 . . . . 999.99 110.975 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -60.24 -45.39 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.33 -0.395 . . . . 799.65 109.973 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -59.63 -47.7 84.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.893 -0.594 . . . . 151.58 110.437 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.444 ' SD ' HD13 ' A' ' 23' ' ' ILE . 18.6 tmm? -59.99 -46.18 90.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 168.43 111.263 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -62.82 -40.96 99.01 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 112.034 0.383 . . . . 530.56 112.034 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.9 p -69.91 -39.34 76.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.84 -0.344 . . . . 293.49 111.476 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -71.98 -42.82 66.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.901 0.381 . . . . 383.72 110.79 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -62.59 -40.17 96.04 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.83 -0.623 . . . . 497.0 111.961 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.84 -40.81 80.95 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.096 0.406 . . . . 177.0 112.096 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -63.66 -42.24 98.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.691 0.281 . . . . 478.76 111.03 179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.06 -39.96 68.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.401 -0.363 . . . . 727.09 111.344 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 tpt -52.53 -43.09 64.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.81 -0.632 . . . . 664.46 112.16 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.67 -43.54 98.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.675 -0.239 . . . . 447.74 111.281 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.22 -40.03 78.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.942 0.401 . . . . 999.99 110.855 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.566 HD13 HD13 ' A' ' 88' ' ' LEU . 96.9 mt -63.14 -44.97 99.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.759 -0.655 . . . . 398.95 110.64 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.03 -41.81 97.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.017 -0.538 . . . . 366.97 110.925 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -62.56 -43.14 99.55 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.616 -0.265 . . . . 709.01 110.873 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.41 -47.46 81.89 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.164 -0.471 . . . . 931.14 111.136 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.41 -45.75 97.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.186 -0.461 . . . . 175.26 111.076 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.203 -0.453 . . . . 443.19 111.449 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.46 97.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.375 -0.375 . . . . 366.44 111.716 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.16 -40.99 77.84 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.909 0.385 . . . . 386.93 111.247 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.72 -8.89 78.19 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 121.155 -0.545 . . . . 244.67 112.733 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -75.2 145.1 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.74 0.305 . . . . 999.99 111.354 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 34.8 p -83.88 120.54 75.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.441 -0.345 . . . . 263.29 110.67 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.98 146.52 37.32 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.498 2.132 . . . . 173.89 112.987 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 m -102.57 169.84 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 201.66 111.158 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.64 -40.48 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.204 -0.453 . . . . 81.09 111.205 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.43 -39.07 94.39 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.152 -0.547 . . . . 106.63 112.94 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.77 -40.53 95.48 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.826 0.346 . . . . 397.23 110.527 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 19' ' ' LEU . 48.9 m-85 -67.92 -40.09 83.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.085 -0.507 . . . . 176.41 111.563 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.3 p -68.26 -34.69 76.65 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.004 -0.278 . . . . 224.32 111.075 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -62.77 -45.2 93.79 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.958 0.408 . . . . 999.99 109.985 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 69' ' ' ILE . 86.2 mt -64.16 -41.33 97.19 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.702 -0.681 . . . . 158.17 110.785 179.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.95 -40.27 99.08 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.992 -0.549 . . . . 65.71 112.432 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.46 92.78 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.671 0.272 . . . . 95.38 111.247 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.01 -39.95 90.7 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.099 0.476 . . . . 381.14 110.734 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.76 -40.05 86.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.545 -0.752 . . . . 182.12 110.943 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.413 ' HA2' ' CE1' ' A' ' 27' ' ' PHE . . . -64.76 -14.14 57.66 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.875 -0.602 . . . . 88.8 114.162 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -78.25 -22.35 48.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.178 0.489 . . . . 999.99 111.441 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -109.01 115.43 30.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.899 0.381 . . . . 999.99 110.842 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.0 pt -131.85 153.04 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 120.876 0.37 . . . . 308.67 111.225 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.8 p-10 -116.24 20.73 14.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 388.05 110.703 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.96 -39.36 91.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.556 . . . . 360.57 111.627 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.26 96.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.895 0.379 . . . . 184.23 110.634 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -69.08 -40.14 78.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.738 -0.665 . . . . 999.99 110.53 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.71 -49.08 79.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.005 -0.543 . . . . 374.13 110.73 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -60.52 -48.3 82.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.067 -0.515 . . . . 999.99 110.869 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.21 -45.91 91.24 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.139 -0.482 . . . . 558.87 111.501 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.9 -40.79 98.63 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.551 -0.295 . . . . 332.85 111.695 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.474 HD11 ' HD3' ' A' ' 112' ' ' PRO . 61.1 tp -61.35 -47.39 86.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.294 -0.412 . . . . 472.21 110.573 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -66.71 -39.03 87.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.197 -0.456 . . . . 821.44 111.017 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.05 -40.63 81.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.92 -0.582 . . . . 746.24 111.953 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -82.52 -11.38 58.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.626 -0.261 . . . . 999.99 111.466 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.8 t30 55.01 44.28 28.46 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.189 0.518 . . . . 675.44 111.699 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 26.5 mmt -117.45 128.74 55.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 999.99 110.534 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.63 116.6 66.56 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.534 -0.303 . . . . 390.38 110.67 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.474 ' HD3' HD11 ' A' ' 105' ' ' LEU . 73.2 Cg_endo -73.53 154.86 50.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.467 2.112 . . . . 243.11 112.312 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -81.7 121.43 26.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.774 0.321 . . . . 618.1 110.231 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -69.26 138.38 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.041 -0.527 . . . . 999.99 110.846 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 83.4 mt -99.24 112.72 63.82 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 415.25 112.011 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -60.45 -27.58 85.13 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.119 2.546 . . . . 529.15 111.996 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -60.57 -26.43 66.93 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.119 -0.946 . . . . 516.88 111.556 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 30.8 mmm -57.18 -28.24 62.62 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.443 0.534 . . . . 914.6 112.443 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -60.2 -44.24 95.27 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.024 -0.361 . . . . 675.31 110.024 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -67.43 -39.19 85.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.064 -0.516 . . . . 900.95 110.821 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.51 -45.05 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.164 -0.471 . . . . 300.73 110.865 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -61.13 -40.11 92.54 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.97 -0.559 . . . . 595.29 111.288 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -67.37 -33.27 74.87 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.202 0.445 . . . . 999.99 112.202 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.4 mtp -76.76 129.74 36.72 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.301 0.482 . . . . 385.68 112.301 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -54.04 147.82 23.84 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 115.537 -0.756 . . . . 999.99 111.441 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.1 -28.2 86.51 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.758 2.306 . . . . 149.6 112.522 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.48 -31.32 72.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.168 -0.469 . . . . 147.02 111.291 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.21 -0.06 57.62 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.073 -0.512 . . . . 360.37 111.696 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.2 t -90.53 115.38 64.03 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.656 0.265 . . . . 187.93 110.636 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.9 159.46 48.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.786 2.324 . . . . 265.39 112.773 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -116.59 136.81 52.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 246.78 109.539 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -113.27 120.83 42.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.926 0.394 . . . . 999.99 111.358 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -84.17 163.37 19.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.825 -0.625 . . . . 495.41 110.23 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.2 mmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.282 -0.866 . . . . 761.34 110.685 -179.502 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.6 t . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.684 0.278 . . . . 375.52 110.7 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -82.27 124.95 77.88 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 999.99 110.363 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.06 141.16 43.3 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.439 2.093 . . . . 436.63 112.835 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -132.04 148.6 52.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.002 -0.545 . . . . 999.99 110.467 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 56.33 43.14 26.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.607 0.567 . . . . 999.99 112.052 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.52 137.02 49.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.268 -0.424 . . . . 781.6 111.251 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -88.04 104.31 16.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.404 . . . . 216.75 110.316 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -63.33 -39.16 93.77 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.775 -0.648 . . . . 902.9 112.166 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -41.31 90.72 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.738 0.304 . . . . 121.35 111.741 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -67.71 -33.91 75.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 265.05 109.932 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 96.5 mt-10 -64.98 -40.45 94.99 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.737 -0.665 . . . . 524.44 110.27 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.58 -46.44 96.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 115.955 -0.566 . . . . 214.56 111.037 179.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.45 92.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.927 -0.579 . . . . 61.91 110.322 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.2 tp -64.11 -39.27 93.67 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.409 -0.814 . . . . 321.59 110.898 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 98.4 mttt -59.22 -37.08 76.63 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.907 -0.588 . . . . 491.97 111.671 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.51 -43.76 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 179.68 110.461 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -68.56 -39.69 80.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.892 0.377 . . . . 483.12 110.554 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.78 -47.4 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.689 -0.687 . . . . 120.91 112.84 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 pt -63.33 -37.39 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 N-CA-C 112.577 0.584 . . . . 324.41 112.577 -178.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.81 91.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.637 0.256 . . . . 76.38 111.441 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.43 -41.91 65.89 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.023 -0.608 . . . . 59.56 113.2 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -73.01 -19.02 61.28 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.731 0.641 . . . . 169.43 112.731 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -75.01 -36.49 61.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.072 -0.251 . . . . 145.09 111.045 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -63.65 -40.53 97.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.929 0.395 . . . . 779.77 110.191 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.65 -39.36 97.46 Favored Glycine 0 C--N 1.333 0.384 0 CA-C-N 115.701 -0.681 . . . . 72.33 112.177 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' SD ' ' A' ' 98' ' ' MET . 83.7 mt -62.63 -40.67 97.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.717 0.294 . . . . 213.67 110.608 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.7 t -61.38 -42.79 95.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.789 -0.641 . . . . 275.82 111.36 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 68.5 mttm -61.38 -41.51 97.23 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.532 -0.304 . . . . 545.0 111.418 -179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -70.62 -43.9 68.34 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.287 0.565 . . . . 999.99 110.211 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 97.2 mt -63.27 -38.97 93.23 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.341 -0.845 . . . . 205.93 113.163 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -63.9 -18.65 64.42 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.508 0.558 . . . . 557.46 112.508 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -84.92 -44.99 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 112.031 0.382 . . . . 284.57 112.031 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -103.28 9.57 38.01 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.773 0.321 . . . . 350.44 111.775 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.99 -21.29 63.45 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.559 0.584 . . . . 199.7 114.559 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.49 -41.19 96.89 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 117.187 0.494 . . . . 999.99 111.696 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.7 p -113.69 10.23 17.92 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.911 0.337 . . . . 302.8 111.911 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.8 tp -71.64 124.58 25.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.126 0.417 . . . . 581.97 112.126 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.2 m -78.98 158.67 27.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 239.07 110.305 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -60.91 -44.78 96.68 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.664 0.269 . . . . 192.01 111.575 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.08 -31.76 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 N-CA-C 112.075 0.398 . . . . 278.45 112.075 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -64.9 -40.15 94.64 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.536 0.208 . . . . 316.42 110.82 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 29.3 ttpp -61.37 -45.86 92.61 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.26 -0.427 . . . . 470.35 110.43 179.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -65.22 -39.66 93.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.045 -0.525 . . . . 369.78 110.674 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.74 92.65 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.877 -0.602 . . . . 66.79 111.295 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.42 -38.58 91.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.095 -0.502 . . . . 238.3 111.785 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.438 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 23.3 m-85 -61.66 -38.96 89.69 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.505 -0.554 . . . . 526.93 109.505 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -65.29 -41.75 93.82 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.674 -0.694 . . . . 162.88 109.74 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.6 t -62.43 -40.4 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.041 -0.527 . . . . 139.01 110.339 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -58.86 -39.42 81.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.561 -0.745 . . . . 198.61 110.963 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.7 mmm-85 -61.77 -42.23 98.72 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.722 -0.217 . . . . 999.99 110.583 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.35 -40.8 96.58 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.06 0.457 . . . . 799.65 110.116 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -61.65 -48.18 82.04 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.608 -0.724 . . . . 151.58 110.93 178.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -60.52 -46.84 88.67 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.828 -0.624 . . . . 168.43 112.023 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -65.65 -33.54 76.12 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 120.733 -0.387 . . . . 530.56 111.145 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.0 m -66.1 -45.99 79.22 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.194 0.521 . . . . 293.49 110.214 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -64.29 -45.29 88.67 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.635 -0.711 . . . . 383.72 110.445 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -62.73 -43.53 98.56 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.666 -0.697 . . . . 497.0 111.845 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.99 78.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.125 0.417 . . . . 177.0 112.125 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -60.07 -49.75 76.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 478.76 110.889 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.431 ' O ' HG12 ' A' ' 69' ' ' ILE . 54.4 m-85 -72.17 -37.76 69.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.328 -0.396 . . . . 727.09 111.658 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -53.0 -46.21 68.22 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.433 0.458 . . . . 664.46 110.788 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.44 -44.44 96.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.989 -0.551 . . . . 447.74 111.276 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -66.91 -40.69 87.76 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.582 0.586 . . . . 999.99 112.582 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.3 pt -79.21 -25.51 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 N-CA-C 112.203 0.446 . . . . 398.95 112.203 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.52 -41.89 95.32 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.529 0.204 . . . . 366.97 110.813 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.6 -47.15 86.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.335 -0.393 . . . . 709.01 110.618 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -63.38 -46.75 85.02 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.928 -0.578 . . . . 931.14 111.286 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.15 -44.99 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.146 -0.479 . . . . 175.26 111.162 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -61.24 -43.85 98.21 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.314 -0.403 . . . . 443.19 111.269 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.02 -40.35 97.47 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.517 -0.311 . . . . 366.44 111.402 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.13 -39.57 82.69 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.295 -0.411 . . . . 386.93 111.253 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.65 -0.04 89.22 Favored Glycine 0 C--N 1.332 0.317 0 CA-C-N 116.0 -0.546 . . . . 244.67 112.508 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 17.2 mmp_? -75.16 149.7 38.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.907 0.384 . . . . 999.99 111.227 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.4 p -106.83 101.07 35.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 263.29 110.807 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 78' ' ' ARG . 43.1 Cg_exo -59.88 142.52 98.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.132 2.555 . . . . 173.89 112.931 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.428 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 15.7 m -100.26 -176.36 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.988 -0.551 . . . . 201.66 110.971 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.7 t -59.64 -43.46 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.39 -0.368 . . . . 81.09 111.082 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.11 -39.55 95.96 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.52 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -62.16 -41.28 98.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.896 0.379 . . . . 397.23 110.72 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.428 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 47.6 m-85 -68.38 -39.95 81.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.968 -0.56 . . . . 176.41 111.416 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.4 p -67.34 -36.0 80.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 111.633 0.234 . . . . 224.32 111.633 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.61 -47.16 84.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.215 0.531 . . . . 999.99 110.095 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 tp -67.99 -42.09 81.29 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.575 -0.739 . . . . 158.17 110.514 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.32 -39.39 97.16 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.763 -0.653 . . . . 65.71 113.042 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -60.77 -40.76 93.73 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.756 0.312 . . . . 95.38 110.869 179.602 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.4 -39.44 93.86 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.097 -0.501 . . . . 381.14 110.352 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.4 mm -63.9 -42.09 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.628 -0.715 . . . . 182.12 110.758 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -71.17 -9.35 67.11 Favored Glycine 0 CA--C 1.521 0.466 0 CA-C-N 115.842 -0.617 . . . . 88.8 113.995 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.3 mmm180 -77.72 -25.96 49.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.314 0.557 . . . . 999.99 111.331 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -108.53 112.15 24.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.891 0.376 . . . . 999.99 110.681 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 79.0 mt -125.68 125.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 308.67 110.591 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -137.44 65.67 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.883 0.373 . . . . 388.05 110.581 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.557 ' SD ' HD23 ' A' ' 31' ' ' LEU . 28.3 ptm -72.38 -21.12 61.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.987 -0.552 . . . . 360.57 110.755 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.27 89.82 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.886 -0.597 . . . . 184.23 110.681 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.22 -48.35 82.1 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.796 -0.638 . . . . 999.99 111.143 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -62.81 -44.06 97.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.354 -0.384 . . . . 374.13 110.301 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -60.67 -47.67 85.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.911 -0.586 . . . . 999.99 110.539 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.46 -41.68 97.59 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.762 -0.654 . . . . 558.87 111.062 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.07 98.08 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.387 -0.37 . . . . 332.85 111.209 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.95 -41.09 97.69 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.46 -0.336 . . . . 472.21 110.598 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -63.0 -44.53 95.77 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.807 -0.633 . . . . 821.44 111.158 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.78 -39.79 82.11 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.075 -0.512 . . . . 746.24 112.155 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -91.37 0.19 57.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.562 -0.29 . . . . 999.99 111.697 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 57.5 36.2 26.68 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.022 0.439 . . . . 675.44 111.21 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 16.7 mmt -100.19 79.39 2.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.167 0.508 . . . . 999.99 111.088 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 71.6 mt -93.65 120.67 65.96 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.896 -0.593 . . . . 390.38 110.17 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.91 149.93 66.63 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.366 2.044 . . . . 243.11 112.504 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -80.11 129.67 34.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 618.1 110.63 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -69.87 86.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.97 -0.559 . . . . 999.99 111.199 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.97 149.67 35.96 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 415.25 111.297 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.18 -25.22 65.27 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.737 2.292 . . . . 529.15 112.322 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -60.63 -45.14 95.17 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.04 -0.527 . . . . 516.88 111.338 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 96.8 mtp -59.99 -40.68 90.01 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.249 -0.432 . . . . 914.6 109.885 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.28 -40.43 96.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.777 -0.647 . . . . 675.31 110.374 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -62.97 -42.13 99.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.859 -0.61 . . . . 900.95 111.179 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.29 -44.49 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.68 0.276 . . . . 300.73 110.449 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -61.25 -41.81 97.55 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.059 -0.518 . . . . 595.29 111.346 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -65.63 -33.88 76.93 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.346 -0.388 . . . . 999.99 111.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.8 mtp -72.57 140.68 48.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 385.68 111.714 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.409 ' O ' HG23 ' A' ' 129' ' ' VAL . 91.3 mtm180 -52.38 141.3 33.13 Favored Pre-proline 0 C--O 1.234 0.281 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.237 178.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -60.78 -25.73 81.67 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.677 2.251 . . . . 149.6 112.548 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.16 80.57 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.029 -0.532 . . . . 147.02 111.618 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.65 -2.54 57.85 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.339 -0.391 . . . . 360.37 111.934 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 125' ' ' ARG . 60.9 t -93.18 116.1 65.99 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.243 -0.28 . . . . 187.93 110.243 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.21 151.03 72.22 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.44 2.094 . . . . 265.39 112.752 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.1 t -109.06 137.43 41.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.913 -0.585 . . . . 246.78 110.134 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.1 141.93 47.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.829 0.347 . . . . 999.99 110.733 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -83.39 158.83 21.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 495.41 110.81 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.348 -0.834 . . . . 761.34 111.139 -179.12 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.7 t . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.919 0.39 . . . . 375.52 111.089 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -91.52 119.98 68.38 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 999.99 110.562 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.44 139.38 34.48 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.295 1.996 . . . . 436.63 112.392 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -98.22 -11.33 22.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.963 0.411 . . . . 999.99 111.292 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -108.85 12.46 25.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.351 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.81 114.49 2.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.017 0.437 . . . . 781.6 111.602 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -114.91 126.77 55.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 216.75 110.037 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.54 -39.49 91.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.769 0.319 . . . . 902.9 110.841 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.77 87.87 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.242 -0.435 . . . . 121.35 111.412 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -68.23 -32.48 72.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.009 -0.541 . . . . 265.05 110.108 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -63.08 -41.61 99.46 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.738 -0.665 . . . . 524.44 109.961 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.12 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 115.803 -0.635 . . . . 214.56 111.033 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.16 -40.87 97.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.232 -0.44 . . . . 61.91 110.626 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.77 -43.01 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.823 -0.626 . . . . 321.59 110.312 178.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -59.72 -44.21 93.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.391 -0.822 . . . . 491.97 111.498 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.66 -42.82 97.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 179.68 111.69 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -63.9 -41.13 97.78 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.738 0.304 . . . . 483.12 111.177 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.263 -0.426 . . . . 120.91 110.582 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.59 -42.87 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 115.972 -0.558 . . . . 324.41 111.325 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.49 95.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.743 0.275 . . . . 76.38 111.743 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.98 -41.28 97.4 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 120.801 -0.714 . . . . 59.56 112.493 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -73.18 -19.6 61.07 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.726 0.41 . . . . 169.43 111.504 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -75.64 -34.67 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.315 . . . . 145.09 111.046 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.75 -44.23 96.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.998 0.428 . . . . 779.77 109.907 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.04 -37.59 94.14 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.533 -0.758 . . . . 72.33 112.521 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.83 -41.27 78.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.71 0.291 . . . . 213.67 110.403 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.9 -44.9 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.018 -0.537 . . . . 275.82 110.779 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 -40.14 95.07 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.756 0.312 . . . . 545.0 110.944 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.6 t90 -64.96 -42.0 94.99 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.315 -0.624 . . . . 999.99 109.315 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 83.6 mt -62.67 -36.68 83.65 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.332 -0.849 . . . . 205.93 111.293 179.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.13 -37.72 86.23 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.585 0.217 . . . . 557.46 111.585 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.2 t -87.01 -50.59 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 113.616 0.969 . . . . 284.57 113.616 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -99.77 -1.49 37.54 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.083 0.771 . . . . 350.44 113.083 -177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -73.51 -11.87 80.19 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 121.233 -0.508 . . . . 199.7 114.05 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.54 -41.17 96.95 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.91 0.355 . . . . 999.99 111.533 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 61.7 p -113.29 5.44 16.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.875 0.369 . . . . 302.8 111.694 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.4 tp -71.85 133.38 45.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.054 -0.521 . . . . 581.97 111.3 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -75.89 161.52 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.039 -0.528 . . . . 239.07 111.266 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.1 -44.54 94.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.998 -0.547 . . . . 192.01 111.913 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.48 -30.4 47.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.558 0.218 . . . . 278.45 111.352 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -67.04 -38.12 85.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.47 -0.332 . . . . 316.42 110.344 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -62.7 -40.41 97.04 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.074 0.464 . . . . 470.35 110.242 178.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -69.48 -33.01 72.26 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.627 -0.715 . . . . 369.78 110.784 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.33 76.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.833 -0.621 . . . . 66.79 111.639 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.0 mt -60.49 -39.18 86.74 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.832 0.308 . . . . 238.3 111.832 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -63.55 -39.04 93.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.916 -0.402 . . . . 526.93 109.916 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -70.11 -40.72 74.72 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.758 -0.655 . . . . 162.88 110.449 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.6 t -63.59 -40.49 89.25 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 N-CA-C 109.655 -0.498 . . . . 139.01 109.655 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -59.34 -39.82 84.41 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.455 -0.793 . . . . 198.61 110.52 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 ttt-85 -60.69 -47.63 85.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.49 -0.323 . . . . 999.99 110.625 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.67 -41.26 96.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.139 0.495 . . . . 799.65 110.552 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -61.89 -47.35 85.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.46 -0.791 . . . . 151.58 110.905 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.5 ttt -59.81 -48.21 82.62 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.429 -0.805 . . . . 168.43 112.82 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -66.04 -31.3 72.1 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.149 0.425 . . . . 530.56 112.149 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.6 m -64.0 -49.72 71.33 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.882 0.372 . . . . 293.49 110.962 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.5 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 76.1 m-70 -72.56 -36.91 68.34 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.235 -0.439 . . . . 383.72 111.636 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -60.13 -45.32 93.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.939 -0.573 . . . . 497.0 111.088 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.76 90.85 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.884 0.327 . . . . 177.0 111.884 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -64.44 -42.22 96.11 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.751 0.31 . . . . 478.76 111.175 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.5 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 38.5 m-85 -70.34 -37.48 74.66 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.245 -0.434 . . . . 727.09 111.371 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.0 ttp -52.29 -46.12 65.79 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.086 -0.506 . . . . 664.46 111.722 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.02 -41.49 98.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.462 -0.335 . . . . 447.74 111.056 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -67.72 -41.59 83.24 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.067 0.46 . . . . 999.99 110.666 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.46 -45.63 97.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 115.637 -0.71 . . . . 398.95 111.223 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -61.86 -40.88 96.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.312 -0.404 . . . . 366.97 111.571 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.77 -42.29 97.82 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.699 0.285 . . . . 709.01 110.747 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.46 -46.16 87.5 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.08 -0.509 . . . . 931.14 111.098 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.64 -46.5 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 CA-C-N 116.196 -0.456 . . . . 175.26 111.111 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.14 -45.3 92.6 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.379 -0.373 . . . . 443.19 111.667 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.56 97.47 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.114 0.413 . . . . 366.44 112.114 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -76.08 -44.36 39.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.865 0.364 . . . . 386.93 111.334 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.46 -10.82 73.27 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.207 -0.521 . . . . 244.67 113.132 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -75.34 155.27 36.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.951 0.405 . . . . 999.99 111.571 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.9 t -93.38 116.95 67.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-N 116.158 -0.473 . . . . 263.29 110.374 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.27 141.9 40.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.322 2.015 . . . . 173.89 113.178 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.45 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 17.9 m -102.45 -176.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 201.66 110.976 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 75.3 t -62.68 -41.03 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.904 0.383 . . . . 81.09 110.112 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.602 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.11 -38.73 94.81 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.795 -0.638 . . . . 106.63 112.39 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -62.02 -40.98 97.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.038 0.447 . . . . 397.23 110.31 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.45 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 48.5 m-85 -69.18 -38.18 78.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.809 -0.632 . . . . 176.41 111.451 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.7 OUTLIER -64.47 -36.12 83.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 121.074 -0.25 . . . . 224.32 110.812 -179.736 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.77 -41.25 92.28 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.027 0.441 . . . . 999.99 110.292 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -66.3 -41.34 89.87 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.733 -0.667 . . . . 158.17 110.388 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.24 -40.07 98.62 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 115.645 -0.707 . . . . 65.71 112.417 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.45 -40.56 94.92 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.484 0.183 . . . . 95.38 111.023 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.13 -40.89 97.15 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.031 0.443 . . . . 381.14 110.659 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.02 -41.5 92.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.75 -0.659 . . . . 182.12 110.658 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -69.29 -10.04 61.96 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.677 -0.692 . . . . 88.8 114.093 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 29.0 mmt85 -78.05 -22.25 49.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.404 0.602 . . . . 999.99 111.299 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -108.42 112.81 25.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.675 0.274 . . . . 999.99 110.314 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.9 mt -126.28 113.54 34.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.108 -0.33 . . . . 308.67 110.108 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -111.62 30.1 7.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.334 -0.394 . . . . 388.05 112.014 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -61.53 -41.33 97.18 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 111.666 0.247 . . . . 360.57 111.666 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.36 94.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.168 0.509 . . . . 184.23 110.989 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -65.31 -35.76 81.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.543 -0.753 . . . . 999.99 111.764 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -58.52 -49.37 77.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.666 0.27 . . . . 374.13 110.987 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -66.09 -38.2 87.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.499 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.37 -41.12 96.57 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.743 0.306 . . . . 558.87 110.349 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.07 -41.32 97.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.114 -0.494 . . . . 332.85 111.132 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.97 -40.9 83.09 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.009 -0.541 . . . . 472.21 111.236 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.18 -39.39 94.52 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.485 -0.325 . . . . 821.44 110.791 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.18 -41.45 83.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.095 -0.502 . . . . 746.24 111.322 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -91.46 1.41 57.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.468 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 58.66 42.21 20.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.058 -0.519 . . . . 675.44 111.512 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 97.7 mmm -102.57 101.82 12.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 999.99 110.795 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.4 mm -94.13 119.81 66.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 390.38 110.794 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.45 153.26 55.34 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.606 2.204 . . . . 243.11 112.434 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -83.91 127.37 33.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.443 -0.344 . . . . 618.1 110.508 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -69.68 122.73 19.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.122 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.9 mt -99.69 117.12 64.17 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 415.25 111.589 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.14 -24.0 38.94 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.423 2.082 . . . . 529.15 112.093 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -65.48 -25.25 67.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.553 -0.749 . . . . 516.88 111.275 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -32.36 49.96 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.018 -0.537 . . . . 914.6 111.953 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.48 -40.12 90.14 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.821 0.343 . . . . 675.31 110.799 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.75 -38.48 89.21 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.94 -0.573 . . . . 900.95 110.872 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.17 -44.95 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.126 -0.488 . . . . 300.73 110.9 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -60.87 -38.4 85.48 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.415 -0.357 . . . . 595.29 111.304 179.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -65.48 -33.07 75.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.154 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 89.7 mmm -70.02 133.58 47.37 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.998 -0.547 . . . . 385.68 111.605 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.478 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.9 mmp_? -53.34 138.41 48.71 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.972 -0.558 . . . . 999.99 111.163 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.84 -38.99 85.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.91 2.406 . . . . 149.6 113.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -65.28 -26.54 68.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.39 -0.368 . . . . 147.02 111.711 179.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -91.68 -3.47 56.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.433 -0.349 . . . . 360.37 111.799 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 125' ' ' ARG . 59.7 t -91.99 114.99 63.8 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.662 0.268 . . . . 187.93 110.543 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.24 147.89 60.77 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.279 1.986 . . . . 265.39 112.344 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.8 m -128.89 153.03 37.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.133 -0.485 . . . . 246.78 110.323 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -128.39 137.28 51.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 999.99 110.979 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -85.21 175.65 8.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.996 -0.547 . . . . 495.41 109.907 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.3 -0.857 . . . . 761.34 110.871 -179.228 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.821 0.343 . . . . 375.52 111.032 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -87.78 154.62 53.1 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 999.99 110.758 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.05 152.41 72.96 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.544 2.163 . . . . 436.63 112.298 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -82.12 55.61 2.88 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.168 0.433 . . . . 999.99 112.168 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 49.53 64.31 1.81 Allowed 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.43 0.456 . . . . 999.99 111.939 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -55.51 132.38 48.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.08 0.467 . . . . 781.6 111.482 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -73.19 132.53 43.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.688 -0.687 . . . . 216.75 111.372 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.07 -41.94 97.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.058 -0.519 . . . . 902.9 111.044 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.53 -39.16 83.02 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.976 0.417 . . . . 121.35 111.375 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.436 ' CD1' ' HB ' ' A' ' 82' ' ' VAL . 11.9 m-30 -68.45 -34.02 75.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.133 -0.485 . . . . 265.05 109.968 179.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.39 -40.6 93.66 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.615 -0.721 . . . . 524.44 111.761 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.625 HG21 ' HA ' ' A' ' 127' ' ' ALA . 9.8 p -69.79 -36.57 70.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 120.777 -0.369 . . . . 214.56 111.378 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -63.78 -42.05 97.82 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 121.102 0.477 . . . . 61.91 110.477 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.89 -40.86 78.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.603 -0.726 . . . . 321.59 111.01 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 24' ' ' ILE . 40.2 ttpt -59.63 -45.17 92.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.726 -0.67 . . . . 491.97 112.559 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.81 -33.14 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 120.861 -0.336 . . . . 179.68 111.346 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.94 -41.52 86.83 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.14 0.495 . . . . 483.12 110.22 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.05 -42.49 88.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.431 -0.804 . . . . 120.91 110.427 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 mm -60.57 -44.12 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 115.754 -0.657 . . . . 324.41 111.268 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.34 97.34 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.53 0.205 . . . . 76.38 111.353 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.37 -41.4 96.54 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 121.005 -0.617 . . . . 59.56 112.675 179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -71.92 -25.55 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.754 0.311 . . . . 169.43 111.335 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.1 t0 -76.91 -36.25 56.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 145.09 110.874 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -60.38 -46.59 89.43 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.845 -0.428 . . . . 779.77 109.845 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.97 -39.27 96.34 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.776 -0.647 . . . . 72.33 112.038 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 60.8 tp -61.64 -40.48 95.06 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 122.659 0.384 . . . . 213.67 111.379 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 28' ' ' ASP . 58.8 t -59.51 -44.26 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.762 -0.199 . . . . 275.82 110.946 -179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.4 -40.78 97.61 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.973 0.416 . . . . 545.0 110.528 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.593 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 72.8 t90 -65.86 -41.66 91.36 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.913 -0.585 . . . . 999.99 109.961 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.424 ' HA ' ' HA3' ' A' ' 39' ' ' GLY . 87.8 mt -61.25 -36.84 81.08 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.64 -0.709 . . . . 205.93 111.468 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.72 -37.77 85.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.551 -0.295 . . . . 557.46 111.296 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.88 -51.16 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 113.53 0.937 . . . . 284.57 113.53 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -109.95 -22.8 11.67 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.174 0.805 . . . . 350.44 113.174 -177.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 35' ' ' LEU . . . -62.38 -21.39 62.18 Favored Glycine 0 N--CA 1.461 0.335 0 C-N-CA 121.145 -0.55 . . . . 199.7 113.828 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -62.84 -18.18 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.079 0.4 . . . . 999.99 112.079 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.0 p -102.81 -6.14 22.88 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.484 0.549 . . . . 302.8 112.484 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.593 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 95.5 mt -73.42 142.77 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.035 0.445 . . . . 581.97 111.719 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.3 m -77.6 161.45 27.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.725 -0.67 . . . . 239.07 110.67 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -41.27 93.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.373 -0.376 . . . . 192.01 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.805 HG13 ' HB2' ' A' ' 114' ' ' TYR . 58.3 t -65.55 -42.74 93.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.157 -0.474 . . . . 278.45 110.721 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.665 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 96.5 mt-30 -63.07 -41.14 99.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.007 -0.542 . . . . 316.42 111.219 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -61.51 -46.69 88.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.262 -0.426 . . . . 470.35 111.353 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.73 -40.17 91.89 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.85 0.357 . . . . 369.78 111.383 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.27 -25.27 68.24 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.046 -0.525 . . . . 66.79 112.214 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 94.0 mt -64.08 -24.37 67.67 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.01 0.744 . . . . 238.3 113.01 -178.588 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -60.57 -40.71 92.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 526.93 110.338 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -70.65 -37.17 73.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.24 -0.436 . . . . 162.88 110.409 178.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.63 -42.89 97.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.685 -0.689 . . . . 139.01 110.529 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -60.66 -40.13 90.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.94 -0.573 . . . . 198.61 111.173 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -60.87 -46.52 90.29 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.747 0.308 . . . . 999.99 110.414 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.42 -38.74 92.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 799.65 110.706 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.93 -49.01 79.37 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.634 -0.712 . . . . 151.58 111.685 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ptm -67.63 -37.16 82.07 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 121.065 -0.254 . . . . 168.43 111.483 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -65.61 -38.0 88.21 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 111.849 0.314 . . . . 530.56 111.849 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -60.15 -48.17 82.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.72 0.295 . . . . 293.49 111.006 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -71.34 -40.44 70.69 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.794 0.33 . . . . 383.72 111.22 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.9 t-105 -62.6 -45.7 91.68 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.418 0.525 . . . . 497.0 112.418 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.25 84.28 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 112.383 0.512 . . . . 177.0 112.383 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -62.02 -48.7 79.1 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.868 0.366 . . . . 478.76 111.155 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -72.15 -37.39 69.42 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.171 -0.468 . . . . 727.09 112.193 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 67.2 ttp -52.73 -46.79 67.57 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.396 -0.365 . . . . 664.46 111.94 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 67' ' ' LEU . 3.1 mm? -63.06 -44.14 96.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.82 -0.173 . . . . 447.74 111.15 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -63.35 -47.09 83.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.983 0.42 . . . . 999.99 110.628 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.34 -42.91 98.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 115.694 -0.685 . . . . 398.95 110.979 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -59.98 -42.06 93.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.232 -0.44 . . . . 366.97 111.428 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.59 -41.39 98.92 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.938 -0.305 . . . . 709.01 110.532 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.97 -45.45 92.38 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.043 -0.526 . . . . 931.14 110.254 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.45 -44.56 99.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.667 -0.697 . . . . 175.26 110.706 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -61.1 -44.57 97.16 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.111 -0.495 . . . . 443.19 111.138 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.4 97.25 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.426 -0.352 . . . . 366.44 111.409 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.73 -39.65 80.27 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.293 -0.412 . . . . 386.93 111.291 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.43 77.46 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.178 -0.534 . . . . 244.67 112.278 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.95 152.61 38.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 999.99 111.442 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.5 p -117.95 94.48 46.43 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.371 -0.377 . . . . 263.29 110.476 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -72.12 150.27 53.62 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.762 2.308 . . . . 173.89 113.331 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.6 m -101.47 173.08 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.703 -0.68 . . . . 201.66 110.536 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 18' ' ' ALA . 9.0 p -56.33 -26.75 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.631 -0.258 . . . . 81.09 111.643 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.26 -38.66 96.04 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 121.11 -0.567 . . . . 106.63 112.012 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -73.62 -29.07 62.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.037 0.446 . . . . 397.23 110.698 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -69.16 -24.82 64.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.637 -0.71 . . . . 176.41 112.217 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 70.2 p -59.29 -35.83 74.48 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.553 0.216 . . . . 224.32 111.127 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -62.66 -44.9 95.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.034 0.445 . . . . 999.99 110.052 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -65.44 -41.04 93.9 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.705 -0.679 . . . . 158.17 110.492 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.17 98.83 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.598 -0.728 . . . . 65.71 112.652 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.29 -40.14 93.03 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.766 0.317 . . . . 95.38 111.098 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -65.22 -41.19 94.66 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.173 -0.467 . . . . 381.14 110.205 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.52 -42.77 96.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 182.12 110.691 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.62 -36.89 92.51 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.785 -0.643 . . . . 88.8 113.445 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -79.67 -10.87 59.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.196 0.443 . . . . 999.99 112.196 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -108.37 112.47 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 999.99 111.03 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.1 pt -131.85 152.09 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.488 -0.324 . . . . 308.67 111.154 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -155.2 38.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.2 0.524 . . . . 388.05 109.791 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 24.7 ptp -74.77 -16.19 60.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.665 -0.698 . . . . 360.57 112.356 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.15 96.62 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.763 0.316 . . . . 184.23 111.356 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -71.15 -35.19 71.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.355 -0.384 . . . . 999.99 110.971 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.74 -46.68 89.5 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.09 -0.504 . . . . 374.13 110.624 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 45.1 m-85 -63.45 -40.94 98.47 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.623 -0.262 . . . . 999.99 110.975 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -63.52 -40.76 97.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.21 -0.45 . . . . 558.87 110.668 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.32 -41.32 98.91 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.945 -0.57 . . . . 332.85 111.25 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -42.7 99.29 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.253 -0.431 . . . . 472.21 110.786 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -64.0 -42.33 97.21 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.252 -0.431 . . . . 821.44 111.082 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.7 -42.65 84.14 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 746.24 111.791 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -89.41 -3.24 58.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.347 . . . . 999.99 111.396 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.89 42.95 28.27 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.58 0.55 . . . . 675.44 111.447 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mtp -99.74 84.2 2.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.211 -0.449 . . . . 999.99 111.22 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.2 mt -94.43 117.05 67.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 390.38 110.303 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.99 139.96 90.38 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.813 2.342 . . . . 243.11 112.718 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.61 144.88 28.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 618.1 110.66 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.805 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.1 t80 -68.55 108.78 3.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.833 0.349 . . . . 999.99 111.155 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.43 138.57 20.51 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.087 -0.506 . . . . 415.25 110.851 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.03 -33.6 96.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.836 2.357 . . . . 529.15 112.042 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -61.06 -38.78 87.42 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.393 -0.821 . . . . 516.88 111.472 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 64.4 mtt -60.18 -41.78 93.6 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.785 0.326 . . . . 914.6 110.532 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -61.88 -42.55 99.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 675.31 110.622 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.12 -41.08 99.27 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.275 -0.421 . . . . 900.95 110.935 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.94 -44.32 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.142 -0.481 . . . . 300.73 110.796 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -38.33 90.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.349 -0.387 . . . . 595.29 111.704 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.44 -35.11 79.94 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.655 0.613 . . . . 999.99 112.655 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.5 ptp -90.51 149.38 22.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.035 0.445 . . . . 385.68 112.175 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.7 mmp_? -53.51 145.61 27.74 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 115.458 -0.792 . . . . 999.99 111.211 178.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.79 -26.21 81.57 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.948 2.432 . . . . 149.6 112.87 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.625 ' HA ' HG21 ' A' ' 17' ' ' VAL . . . -62.35 -35.98 80.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 147.02 111.695 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.73 -1.08 57.88 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.45 -0.341 . . . . 360.37 111.785 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 94.0 t -81.87 121.99 79.71 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 187.93 110.758 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -68.56 149.1 73.86 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.39 2.06 . . . . 265.39 112.534 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.71 137.95 55.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.9 -0.591 . . . . 246.78 110.052 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -122.35 136.71 54.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 999.99 110.875 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.12 171.3 12.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 495.41 110.45 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.185 -0.912 . . . . 761.34 111.115 -179.274 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.5 t . . . . . 0 C--O 1.233 0.191 0 N-CA-C 109.904 -0.406 . . . . 375.52 109.904 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 pm0 -79.16 156.74 76.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 999.99 110.959 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -68.37 152.14 75.65 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.425 2.083 . . . . 436.63 112.573 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -109.59 151.24 27.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.399 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -82.14 73.5 9.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 999.99 111.087 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.96 151.38 14.89 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.608 -0.724 . . . . 781.6 111.351 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -61.57 129.05 39.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.354 -0.385 . . . . 216.75 110.582 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.74 -39.94 93.33 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.07 -0.514 . . . . 902.9 111.655 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.03 87.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.013 0.435 . . . . 121.35 111.422 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -70.52 -34.72 72.62 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 265.05 110.222 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -67.01 -41.14 87.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.699 -0.682 . . . . 524.44 112.07 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.787 HG11 ' HA ' ' A' ' 127' ' ' ALA . 30.1 m -73.8 -28.99 25.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 N-CA-C 112.033 0.383 . . . . 214.56 112.033 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.73 93.29 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.222 0.534 . . . . 61.91 109.892 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.11 -36.06 72.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.279 -0.873 . . . . 321.59 111.081 178.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.48 ' O ' HG12 ' A' ' 24' ' ' ILE . 64.4 tttm -59.11 -41.93 89.34 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.641 -0.709 . . . . 491.97 111.712 -178.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.88 -44.6 99.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.584 0.23 . . . . 179.68 110.99 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -64.71 -43.26 94.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.944 0.402 . . . . 483.12 110.955 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.4 -43.92 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 115.795 -0.639 . . . . 120.91 111.59 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 20' ' ' LYS . 29.9 mm -61.06 -41.23 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 116.373 -0.376 . . . . 324.41 111.451 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.03 95.05 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.524 0.194 . . . . 76.38 111.524 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.48 -41.37 98.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.831 -0.699 . . . . 59.56 112.548 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -74.48 -20.1 60.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.633 0.254 . . . . 169.43 111.531 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -76.13 -37.27 58.23 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.969 -0.382 . . . . 145.09 109.969 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -63.3 -40.69 98.06 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.103 -0.703 . . . . 779.77 109.103 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.503 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.81 -37.23 93.96 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.013 -0.994 . . . . 72.33 112.58 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 82.0 mt -58.76 -36.53 74.52 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.164 0.186 . . . . 213.67 111.171 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.32 -41.61 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 116.214 -0.448 . . . . 275.82 111.222 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.52 -42.57 99.01 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.525 0.202 . . . . 545.0 111.381 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.503 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 8.0 m-90 -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.531 0.205 . . . . 999.99 110.992 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.3 mt -62.78 -37.21 85.75 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.93 0.395 . . . . 205.93 110.863 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.94 -37.29 86.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.322 -0.399 . . . . 557.46 111.384 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.66 -51.99 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 113.424 0.898 . . . . 284.57 113.424 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.93 -21.26 12.73 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.967 0.728 . . . . 350.44 112.967 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.641 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.73 -37.9 93.08 Favored Glycine 0 N--CA 1.46 0.25 0 C-N-CA 121.233 -0.508 . . . . 199.7 113.325 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -61.71 -20.46 63.52 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.988 0.366 . . . . 999.99 111.988 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.3 p -105.63 -4.36 21.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.983 0.364 . . . . 302.8 111.983 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.641 HD12 ' HA2' ' A' ' 39' ' ' GLY . 91.0 mt -72.92 146.28 46.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.084 0.469 . . . . 581.97 111.63 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.0 m -76.82 164.55 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.808 -0.633 . . . . 239.07 110.582 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.6 m -59.67 -41.95 91.78 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.346 -0.388 . . . . 192.01 111.072 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 114' ' ' TYR . 69.5 t -65.87 -42.47 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.26 -0.427 . . . . 278.45 110.482 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -63.28 -40.59 97.81 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.125 -0.488 . . . . 316.42 111.16 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -61.38 -46.66 89.27 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.271 -0.422 . . . . 470.35 110.784 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.58 -39.71 91.94 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.303 -0.408 . . . . 369.78 111.177 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.27 83.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.722 -0.672 . . . . 66.79 111.907 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.6 -32.08 49.64 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.77 0.656 . . . . 238.3 112.77 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -62.93 -42.88 99.94 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.801 0.334 . . . . 526.93 110.751 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -70.99 -39.27 72.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.196 0.522 . . . . 162.88 109.813 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -60.5 -41.42 87.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.252 -0.885 . . . . 139.01 111.191 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -58.68 -45.19 89.97 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.501 0.191 . . . . 198.61 110.921 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -65.07 -41.59 94.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.747 0.308 . . . . 999.99 110.747 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -63.9 -40.84 97.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.266 0.555 . . . . 799.65 110.253 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -58.96 -48.51 81.27 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.282 -0.872 . . . . 151.58 110.376 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -45.7 92.03 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.729 -0.669 . . . . 168.43 111.49 179.235 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.54 -39.65 94.29 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.264 -0.425 . . . . 530.56 111.689 -179.108 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.5 m -61.09 -47.06 88.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.985 0.421 . . . . 293.49 110.776 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.49 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 67.7 m80 -70.12 -38.71 75.65 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.088 -0.505 . . . . 383.72 111.346 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -60.29 -48.16 82.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.301 -0.409 . . . . 497.0 111.02 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.64 94.19 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 111.843 0.312 . . . . 177.0 111.843 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.85 -48.45 78.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.426 -0.352 . . . . 478.76 111.727 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.49 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 62.7 m-85 -71.06 -36.38 72.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.524 -0.307 . . . . 727.09 111.79 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 62.4 ttp -52.42 -44.89 65.67 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.381 0.425 . . . . 664.46 112.062 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.8 mt -61.45 -42.23 98.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.479 0.18 . . . . 447.74 111.16 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -68.84 -40.39 79.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 999.99 110.593 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 88' ' ' LEU . 95.1 mt -63.65 -44.84 98.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.761 -0.654 . . . . 398.95 110.883 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.69 -39.43 88.46 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.282 -0.417 . . . . 366.97 111.567 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.28 -48.19 82.8 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.857 0.361 . . . . 709.01 110.496 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.7 tptm -64.79 -45.11 87.68 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.858 -0.61 . . . . 931.14 111.092 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 37.4 mm -62.96 -45.8 97.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.028 -0.533 . . . . 175.26 111.948 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -61.6 -40.46 94.9 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.745 -0.207 . . . . 443.19 110.997 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.5 95.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.345 . . . . 366.44 111.135 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.9 mt -70.06 -39.94 75.36 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.189 -0.46 . . . . 386.93 111.425 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.9 -8.82 79.26 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 121.107 -0.568 . . . . 244.67 112.411 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -74.73 152.07 39.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.622 0.249 . . . . 999.99 111.318 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -115.2 94.36 38.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.51 -0.314 . . . . 263.29 110.987 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.34 143.23 97.78 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.323 2.682 . . . . 173.89 113.446 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.429 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 16.2 m -100.76 -177.82 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.842 -0.617 . . . . 201.66 110.607 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.1 t -58.13 -42.48 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-N 116.421 -0.354 . . . . 81.09 110.88 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -39.47 96.83 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.28 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.21 -38.52 91.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 397.23 111.428 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 39.3 m-85 -67.91 -26.4 65.97 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.749 0.648 . . . . 176.41 112.749 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -57.14 -34.66 68.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 121.004 -0.278 . . . . 224.32 111.218 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -65.53 -41.11 93.43 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.954 0.407 . . . . 999.99 110.484 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 69' ' ' ILE . 86.8 mt -66.93 -40.96 87.75 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.796 -0.638 . . . . 158.17 110.493 179.144 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.74 -40.73 99.57 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.626 -0.715 . . . . 65.71 112.178 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.96 -39.77 93.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.636 0.255 . . . . 95.38 110.933 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.05 -40.48 94.8 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.254 -0.43 . . . . 381.14 110.595 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.93 -42.57 96.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.897 -0.592 . . . . 182.12 110.348 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -65.05 -17.33 63.27 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.787 -0.642 . . . . 88.8 113.437 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -80.09 -13.03 59.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.987 0.394 . . . . 999.99 111.178 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -107.48 112.1 24.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 999.99 110.282 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 78.2 mt -125.4 125.95 69.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.292 -0.413 . . . . 308.67 110.746 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -130.6 48.53 2.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.077 0.465 . . . . 388.05 110.516 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 67.2 mtt -66.77 -35.54 80.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.654 -0.703 . . . . 360.57 111.661 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.4 -38.12 79.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.32 -0.4 . . . . 184.23 111.33 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -59.27 -47.13 86.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.272 -0.422 . . . . 999.99 110.397 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -58.62 -48.26 81.59 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.106 -0.497 . . . . 374.13 111.249 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 58.1 m-85 -62.81 -41.63 99.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.768 0.318 . . . . 999.99 110.985 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -64.23 -43.6 94.45 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.076 -0.511 . . . . 558.87 111.224 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.77 -41.36 97.6 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.154 -0.475 . . . . 332.85 111.721 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.91 -48.48 76.43 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.465 -0.334 . . . . 472.21 111.08 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.94 -40.21 95.91 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.678 0.275 . . . . 821.44 111.283 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.62 -44.67 90.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.19 -0.459 . . . . 746.24 111.959 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -86.53 -11.26 52.13 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.897 0.332 . . . . 999.99 111.897 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.07 39.94 31.73 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.397 0.435 . . . . 675.44 111.778 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mmm -109.68 108.8 19.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.871 0.367 . . . . 999.99 111.483 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.46 120.02 65.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 390.38 110.126 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.61 146.14 54.12 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.279 1.986 . . . . 243.11 112.754 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -84.94 142.26 29.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 618.1 110.692 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.51 ' HB2' HG13 ' A' ' 45' ' ' VAL . 78.2 t80 -69.34 109.6 4.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.401 -0.363 . . . . 999.99 110.969 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.59 126.02 40.64 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.437 -0.347 . . . . 415.25 111.011 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -56.91 -32.63 93.05 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.042 2.495 . . . . 529.15 112.355 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -59.74 -45.28 92.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.758 -0.655 . . . . 516.88 111.642 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 77.9 mtm -60.16 -40.89 91.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.695 0.283 . . . . 914.6 110.253 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 55.2 tp10 -60.79 -43.0 98.68 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.976 -0.557 . . . . 675.31 110.104 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.505 ' O ' ' HG2' ' A' ' 124' ' ' MET . 88.9 tt0 -61.62 -44.74 96.43 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.813 -0.63 . . . . 900.95 110.973 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.8 mm -61.53 -43.74 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 CA-C-N 116.419 -0.355 . . . . 300.73 111.392 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -61.8 -38.66 88.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.624 0.25 . . . . 595.29 111.474 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -66.44 -32.66 74.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.338 -0.392 . . . . 999.99 111.771 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 120' ' ' GLU . 26.5 mmt -70.43 141.31 52.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.503 -0.317 . . . . 385.68 111.416 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.499 ' O ' HG23 ' A' ' 129' ' ' VAL . 95.7 mtm-85 -52.26 139.46 35.98 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 115.776 -0.647 . . . . 999.99 111.044 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -60.44 -25.97 81.7 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.734 2.289 . . . . 149.6 112.794 -179.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.787 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -62.22 -36.7 82.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 147.02 111.43 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -92.12 -0.09 57.45 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.191 0.441 . . . . 360.37 112.191 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.0 t -89.59 117.55 68.25 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.692 0.282 . . . . 187.93 111.305 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -72.83 160.85 45.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.814 2.343 . . . . 265.39 112.388 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 92.3 t -106.18 137.19 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.936 0.398 . . . . 246.78 110.444 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -96.4 126.94 41.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 999.99 110.891 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -82.76 149.66 27.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 495.41 110.15 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.3 mmt . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.471 -0.776 . . . . 761.34 110.767 -179.718 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.7 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.766 0.317 . . . . 375.52 111.037 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.29 126.49 60.36 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.967 -0.561 . . . . 999.99 110.704 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.656 ' HB3' HD12 ' A' ' 11' ' ' LEU . 59.9 Cg_exo -56.55 134.66 65.79 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.712 2.275 . . . . 436.63 112.2 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -125.59 -47.07 1.71 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.465 -0.334 . . . . 999.99 111.838 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -105.28 -7.79 18.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.327 0.491 . . . . 999.99 112.327 -178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.656 HD12 ' HB3' ' A' ' 8' ' ' PRO . 92.0 mt -58.81 138.99 56.93 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.886 0.374 . . . . 781.6 111.573 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -100.3 118.51 36.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 216.75 110.179 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -61.6 -38.94 89.43 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.003 -0.544 . . . . 902.9 111.643 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.03 87.29 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.856 0.36 . . . . 121.35 111.396 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -70.07 -30.72 68.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 265.05 110.03 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -64.38 -39.05 93.11 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.746 -0.661 . . . . 524.44 109.526 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.31 -44.88 96.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.51 -0.768 . . . . 214.56 111.017 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 21' ' ' VAL . . . -61.89 -38.77 89.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.151 0.501 . . . . 61.91 110.397 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.6 -39.61 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.759 -0.655 . . . . 321.59 111.085 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 24' ' ' ILE . 98.1 mttt -60.23 -41.24 92.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.81 0.671 . . . . 491.97 112.81 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 18' ' ' ALA . 9.9 p -66.03 -36.36 77.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 120.719 -0.393 . . . . 179.68 111.208 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.432 ' OE1' ' HA ' ' A' ' 86' ' ' THR . 63.1 tt0 -67.02 -39.98 87.15 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.101 0.477 . . . . 483.12 110.249 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.89 -43.52 98.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 115.544 -0.753 . . . . 120.91 110.436 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 20' ' ' LYS . 31.8 mm -60.09 -43.91 93.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-N 115.511 -0.768 . . . . 324.41 111.775 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.96 95.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.013 0.375 . . . . 76.38 112.013 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.3 -42.83 95.95 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.731 -0.747 . . . . 59.56 113.103 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HE1' HG22 ' A' ' 92' ' ' ILE . 38.0 m-85 -74.69 -19.81 60.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.056 0.391 . . . . 169.43 112.056 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.427 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.7 t0 -76.42 -39.48 53.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.738 -0.21 . . . . 145.09 111.182 -178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -62.55 -43.33 99.08 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.947 0.403 . . . . 779.77 109.944 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.31 -39.58 94.37 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.691 -0.686 . . . . 72.33 112.225 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -63.24 -42.56 99.24 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 122.33 0.252 . . . . 213.67 111.209 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 28' ' ' ASP . 63.0 t -60.94 -46.03 97.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.567 -0.288 . . . . 275.82 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -63.17 -41.25 99.2 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.848 0.356 . . . . 545.0 110.636 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -63.92 -44.13 93.83 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.337 0.589 . . . . 999.99 109.978 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.461 HD21 ' HE3' ' A' ' 47' ' ' LYS . 61.7 tp -60.77 -39.07 87.43 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.104 -0.953 . . . . 205.93 111.42 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -64.4 -25.01 67.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.907 0.336 . . . . 557.46 111.907 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.3 t -86.81 -51.06 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 N-CA-C 113.128 0.788 . . . . 284.57 113.128 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.653 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.1 m-70 -98.98 -4.03 33.56 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.737 0.643 . . . . 350.44 112.737 -178.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.49 -34.9 70.16 Favored Glycine 0 N--CA 1.46 0.289 0 CA-C-N 116.169 -0.468 . . . . 199.7 114.086 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -62.26 -19.91 63.71 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.098 0.407 . . . . 999.99 112.098 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.492 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.2 p -111.69 -13.06 13.8 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.792 0.664 . . . . 302.8 112.792 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 95.1 mt -72.96 137.27 45.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.804 0.335 . . . . 581.97 111.815 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.5 p -78.04 165.47 23.98 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.305 -0.407 . . . . 239.07 110.359 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.8 m -61.76 -44.15 97.45 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.771 0.319 . . . . 192.01 111.188 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.627 HG13 ' HB2' ' A' ' 114' ' ' TYR . 70.6 t -66.91 -43.69 89.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.219 -0.446 . . . . 278.45 111.035 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 64.9 tt0 -63.11 -40.78 98.62 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.453 . . . . 316.42 111.12 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HE3' HD21 ' A' ' 35' ' ' LEU . 87.8 tttt -60.36 -47.12 87.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.311 -0.404 . . . . 470.35 111.241 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.88 -40.38 95.02 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.906 0.384 . . . . 369.78 110.914 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.68 86.13 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.711 -0.677 . . . . 66.79 111.647 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 83.9 mt -60.61 -35.63 76.61 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.899 0.703 . . . . 238.3 112.899 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -59.67 -41.24 90.16 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.969 -0.382 . . . . 526.93 109.969 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -68.69 -39.41 80.53 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.217 -0.447 . . . . 162.88 109.898 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.446 HG11 ' CE2' ' A' ' 101' ' ' PHE . 57.4 t -60.32 -41.29 86.64 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 CA-C-N 115.877 -0.601 . . . . 139.01 110.442 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -59.11 -42.43 90.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.427 -0.351 . . . . 198.61 110.394 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.655 ' O ' ' HG2' ' A' ' 58' ' ' MET . 98.7 mtt180 -64.77 -42.54 95.04 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.18 -0.464 . . . . 999.99 110.439 178.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -65.31 -42.71 92.72 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.496 0.665 . . . . 799.65 110.633 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -60.59 -47.02 88.05 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.96 -1.018 . . . . 151.58 111.865 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 55' ' ' ARG . 14.0 ptt? -58.98 -39.27 81.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.745 0.307 . . . . 168.43 110.852 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.453 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 29.5 mm100 -69.63 -39.05 77.39 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.189 -0.46 . . . . 530.56 111.2 179.055 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.7 m -61.44 -48.01 83.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.288 -0.414 . . . . 293.49 110.959 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.6 -48.53 79.0 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.083 -0.508 . . . . 383.72 110.827 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.4 t-105 -64.85 -40.24 94.84 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.912 0.708 . . . . 497.0 112.912 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.93 -37.9 72.13 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.915 0.709 . . . . 177.0 112.915 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.68 -46.97 87.46 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.674 0.273 . . . . 478.76 110.977 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -77.83 -41.1 38.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.418 -0.355 . . . . 727.09 111.127 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.6 ttt -53.6 -45.02 69.88 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.013 0.745 . . . . 664.46 113.013 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.2 tp -57.81 -45.46 86.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.014 0.375 . . . . 447.74 112.014 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -65.56 -40.87 93.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 999.99 111.172 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mm -70.63 -42.97 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.115 -0.493 . . . . 398.95 111.082 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -60.66 -38.9 86.41 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.805 -0.634 . . . . 366.97 111.925 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.22 -46.33 88.76 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 110.261 -0.274 . . . . 709.01 110.261 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.79 -41.28 92.18 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.357 -0.383 . . . . 931.14 111.071 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.05 -45.69 98.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.381 -0.372 . . . . 175.26 110.998 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.85 -43.1 99.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.175 -0.466 . . . . 443.19 111.124 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.51 -40.26 96.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.348 -0.387 . . . . 366.44 111.09 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.58 -38.54 80.78 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.169 -0.469 . . . . 386.93 111.343 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.7 5.02 75.16 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.952 -0.642 . . . . 244.67 112.48 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -74.18 147.56 42.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.867 0.365 . . . . 999.99 111.269 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -102.9 109.39 61.23 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 263.29 110.812 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -59.43 138.44 84.17 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.746 2.297 . . . . 173.89 112.549 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.9 m -102.37 172.61 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.447 . . . . 201.66 111.692 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.3 t -61.16 -41.13 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 115.68 -0.691 . . . . 81.09 110.97 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.02 -41.88 98.14 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.782 -0.723 . . . . 106.63 112.398 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.84 -40.13 94.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.128 0.489 . . . . 397.23 110.216 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -66.63 -39.88 88.48 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.517 -0.765 . . . . 176.41 111.591 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.9 OUTLIER -64.22 -34.33 77.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.988 -0.285 . . . . 224.32 111.025 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.73 -40.99 92.74 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.212 0.529 . . . . 999.99 109.593 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.98 -38.61 86.38 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.327 -0.851 . . . . 158.17 110.476 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.99 -39.18 95.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.621 -0.718 . . . . 65.71 113.067 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.7 97.12 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.895 0.379 . . . . 95.38 110.2 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.4 -40.39 89.58 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.839 -0.619 . . . . 381.14 110.363 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.437 HG22 ' HE1' ' A' ' 27' ' ' PHE . 97.3 mt -61.61 -45.6 98.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.729 -0.669 . . . . 182.12 111.321 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -81.9 -2.56 90.59 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.937 -0.649 . . . . 88.8 113.64 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -79.45 -30.67 42.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.123 0.461 . . . . 999.99 110.953 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -108.63 112.65 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.512 -0.313 . . . . 999.99 110.937 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.7 mm -124.89 125.55 69.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.585 -0.524 . . . . 308.67 109.585 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -141.76 68.97 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.894 0.378 . . . . 388.05 111.582 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.3 mmm -70.97 -28.21 64.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.86 -0.609 . . . . 360.57 111.192 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.21 -38.16 82.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.66 -0.7 . . . . 184.23 112.031 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -59.24 -48.8 80.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.4 -0.363 . . . . 999.99 111.135 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.446 ' CE2' HG11 ' A' ' 53' ' ' VAL . 83.3 t80 -60.01 -46.81 88.26 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.585 -0.279 . . . . 374.13 110.962 179.414 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -58.44 -47.44 83.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.037 -0.529 . . . . 999.99 111.141 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.7 -46.08 91.75 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.578 -0.283 . . . . 558.87 110.804 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.16 98.08 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.256 -0.429 . . . . 332.85 111.378 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.49 -45.23 93.96 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.981 -0.554 . . . . 472.21 110.956 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -62.75 -39.31 93.71 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.243 -0.435 . . . . 821.44 110.782 179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.13 -40.95 82.61 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.962 -0.563 . . . . 746.24 111.39 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -83.41 -11.73 57.25 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.518 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.5 t30 54.06 45.99 26.39 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 122.96 0.504 . . . . 675.44 111.781 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.4 mtp -107.91 113.85 27.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.881 0.372 . . . . 999.99 111.361 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.8 mt -94.33 118.73 67.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 390.38 110.185 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.66 139.51 34.11 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.307 2.005 . . . . 243.11 112.97 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -86.07 141.27 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 618.1 110.692 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.627 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.8 t80 -68.66 119.93 13.86 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.714 0.292 . . . . 999.99 110.615 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -98.59 123.83 48.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.47 -0.332 . . . . 415.25 111.322 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -57.83 -31.74 93.19 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.953 2.435 . . . . 529.15 112.449 178.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -61.24 -28.17 68.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.696 -0.684 . . . . 516.88 111.702 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.06 -37.66 80.53 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.337 -0.392 . . . . 914.6 111.093 -179.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.58 -40.32 91.28 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 675.31 110.933 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.27 -40.55 96.22 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.475 -0.329 . . . . 900.95 110.978 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.2 mm -61.43 -45.72 98.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.152 -0.477 . . . . 300.73 110.673 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -39.1 93.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.817 -0.628 . . . . 595.29 111.995 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 54.8 mmm-85 -67.72 -34.25 76.49 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.2 ptp -81.3 151.02 28.25 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.129 0.49 . . . . 385.68 112.252 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -51.75 134.52 36.54 Favored Pre-proline 0 N--CA 1.466 0.353 0 CA-C-N 115.285 -0.87 . . . . 999.99 111.457 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -53.12 -32.59 59.94 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.303 2.668 . . . . 149.6 113.171 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.07 -36.25 76.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 147.02 111.663 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -91.87 8.14 38.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.453 -0.34 . . . . 360.37 111.736 -179.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 72.8 t -91.43 114.78 62.87 Favored Pre-proline 0 C--O 1.234 0.244 0 CA-C-O 120.818 0.342 . . . . 187.93 110.965 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.46 157.59 49.02 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.676 2.251 . . . . 265.39 112.772 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.453 ' HB ' ' HG3' ' A' ' 59' ' ' GLN . 16.7 m -126.84 158.82 37.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.074 -0.512 . . . . 246.78 110.593 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -113.98 128.94 56.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.881 0.372 . . . . 999.99 111.297 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -83.17 161.62 21.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.928 -0.578 . . . . 495.41 109.985 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.173 -0.918 . . . . 761.34 110.687 -179.411 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 40.4 ttp-105 . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.951 0.405 . . . . 999.99 111.896 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -142.47 152.21 42.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 999.99 110.666 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -153.06 162.25 41.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.308 -0.405 . . . . 999.99 109.91 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -108.15 140.07 41.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.454 -0.339 . . . . 999.99 110.344 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -85.48 108.25 17.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.009 0.433 . . . . 999.99 110.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.6 t -125.08 127.42 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 375.52 110.031 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -91.11 116.1 65.74 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.682 -0.236 . . . . 999.99 110.418 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' OD1' ' A' ' 74' ' ' ASP . 59.9 Cg_endo -72.4 140.2 33.04 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.135 . . . . 436.63 112.783 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -99.68 -12.7 19.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 999.99 111.17 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -107.98 10.79 28.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.087 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.05 124.62 19.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.856 -0.611 . . . . 781.6 111.909 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.522 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.5 t-20 -109.98 110.34 21.23 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.311 -0.626 . . . . 216.75 109.311 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.08 -39.34 92.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.294 0.479 . . . . 902.9 112.294 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.83 -41.21 90.83 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.95 0.352 . . . . 121.35 111.95 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -72.56 -27.71 62.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.411 -0.358 . . . . 265.05 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 12' ' ' ASN . 78.2 mm-40 -63.97 -40.04 95.51 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.104 -0.498 . . . . 524.44 112.115 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 14' ' ' ALA . 9.3 p -67.27 -36.07 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 120.757 -0.377 . . . . 214.56 110.938 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.84 -42.61 99.81 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.195 0.521 . . . . 61.91 109.98 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.6 tp -66.08 -42.68 89.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.23 -0.895 . . . . 321.59 110.758 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.16 -41.75 93.45 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.588 -0.733 . . . . 491.97 111.603 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' VAL . 65.7 t -63.15 -43.09 98.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 116.61 -0.268 . . . . 179.68 111.067 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.08 -40.97 97.41 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.884 0.374 . . . . 483.12 110.564 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.58 -43.92 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 115.829 -0.623 . . . . 120.91 111.025 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.3 mt -61.02 -44.16 97.64 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 116.124 -0.489 . . . . 324.41 111.388 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.13 -43.52 95.63 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.58 0.229 . . . . 76.38 111.222 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.78 -39.39 96.59 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 121.146 -0.549 . . . . 59.56 112.435 178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -72.38 -20.59 61.42 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.6 0.36 . . . . 169.43 111.718 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -78.1 -23.57 47.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.183 -0.207 . . . . 145.09 111.535 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' VAL . 95.6 mtt-85 -65.48 -42.48 92.17 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.089 0.471 . . . . 779.77 110.026 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -25.14 73.58 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.722 -0.672 . . . . 72.33 112.636 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.0 tp -63.09 -44.68 95.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.592 0.234 . . . . 213.67 111.248 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.565 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.0 p -66.41 -31.73 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.462 -0.335 . . . . 275.82 111.137 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.51 -40.58 95.9 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.971 0.415 . . . . 545.0 110.258 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.3 t90 -67.07 -38.94 86.66 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.706 -0.679 . . . . 999.99 109.292 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 32' ' ' VAL . 92.5 mt -61.37 -36.34 79.97 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.029 -0.987 . . . . 205.93 111.298 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -65.5 -21.27 66.61 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.058 0.392 . . . . 557.46 112.058 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 63.6 t -86.43 -47.59 16.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 112.521 0.563 . . . . 284.57 112.521 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.14 17.23 21.84 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.279 0.474 . . . . 350.44 112.279 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.81 -39.29 96.6 Favored Glycine 0 CA--C 1.518 0.239 0 N-CA-C 114.446 0.538 . . . . 199.7 114.446 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.2 ptt180 -63.27 -26.32 68.72 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.492 0.553 . . . . 999.99 112.492 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.543 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.1 p -113.15 8.11 18.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.96 0.356 . . . . 302.8 111.96 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.4 tp -72.39 121.98 20.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.805 0.336 . . . . 581.97 111.535 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.6 p -80.78 169.24 17.84 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.385 -0.371 . . . . 239.07 110.258 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.3 m -62.38 -43.96 97.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.741 0.305 . . . . 192.01 111.209 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -28.42 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 278.45 112.539 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 15.0 mm100 -62.71 -39.45 94.08 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.42 0.155 . . . . 316.42 111.42 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -60.57 -46.84 88.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.86 0.362 . . . . 470.35 110.202 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.91 -38.6 86.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.872 -0.604 . . . . 369.78 110.794 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.01 81.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.662 -0.699 . . . . 66.79 111.496 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.4 mt -60.88 -36.41 79.12 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.158 -0.474 . . . . 238.3 111.796 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -61.07 -39.49 90.1 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.372 -0.603 . . . . 526.93 109.372 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -65.97 -40.94 91.71 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.619 -0.719 . . . . 162.88 109.603 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.42 HG13 ' CE2' ' A' ' 101' ' ' PHE . 55.3 t -61.57 -41.97 92.28 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 115.729 -0.669 . . . . 139.01 110.448 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -59.49 -41.65 90.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.927 -0.579 . . . . 198.61 110.821 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.2 -41.95 96.84 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.068 -0.253 . . . . 999.99 110.619 178.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -64.79 -40.23 94.9 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.29 0.567 . . . . 799.65 109.982 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -60.42 -46.62 89.37 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.083 -0.962 . . . . 151.58 110.234 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ttt -59.11 -43.65 91.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.772 -0.649 . . . . 168.43 110.795 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -62.72 -42.61 99.74 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.799 0.333 . . . . 530.56 110.993 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.1 m -68.32 -42.89 78.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.22 0.533 . . . . 293.49 110.861 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.419 ' NE2' ' HE1' ' A' ' 65' ' ' TYR . 71.7 t60 -63.27 -38.74 92.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.512 -0.767 . . . . 383.72 110.759 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -55.95 -32.66 64.04 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.893 -0.594 . . . . 497.0 112.553 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.74 -38.68 78.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 177.0 111.681 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -43.46 97.45 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.897 0.379 . . . . 478.76 111.73 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.419 ' HE1' ' NE2' ' A' ' 61' ' ' HIS . 76.8 m-85 -84.74 -20.45 31.07 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.706 0.632 . . . . 727.09 112.706 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.7 ttt -50.92 -50.19 58.16 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.568 0.581 . . . . 664.46 112.568 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 87.3 mt -64.6 -41.9 95.92 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 111.9 0.333 . . . . 447.74 111.9 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -71.26 -52.76 17.15 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.398 0.888 . . . . 999.99 113.398 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.1 mt -84.85 -60.09 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 114.752 1.39 . . . . 398.95 114.752 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.23 -42.19 99.21 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.373 1.249 . . . . 366.97 114.373 -175.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 40.2 ttpt -62.22 -45.91 91.24 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.739 -0.384 . . . . 709.01 111.297 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -65.13 -42.43 93.86 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.92 0.341 . . . . 931.14 111.92 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.2 mt -62.88 -46.78 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.628 0.251 . . . . 175.26 111.203 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 36.6 t70 -63.0 -45.6 91.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.355 -0.384 . . . . 443.19 111.468 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.01 -40.63 96.78 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.069 0.396 . . . . 366.44 112.069 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.14 -39.18 79.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.319 . . . . 386.93 111.522 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.03 -3.47 84.55 Favored Glycine 0 CA--C 1.518 0.27 0 C-N-CA 120.844 -0.693 . . . . 244.67 112.311 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -74.15 149.87 40.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.826 0.346 . . . . 999.99 111.036 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.0 p -112.63 95.31 32.03 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.338 -0.392 . . . . 263.29 111.059 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.86 146.08 98.06 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.061 2.507 . . . . 173.89 112.463 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.92 -179.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.232 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.69 -42.33 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.28 -0.418 . . . . 81.09 111.157 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.563 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.58 -40.45 97.87 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.682 -0.771 . . . . 106.63 112.143 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.81 -40.95 96.05 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.902 0.382 . . . . 397.23 110.718 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -68.55 -37.69 80.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.868 -0.605 . . . . 176.41 112.278 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -61.48 -35.15 76.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.917 -0.313 . . . . 224.32 111.077 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.2 mmm180 -66.75 -40.65 88.39 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.171 0.51 . . . . 999.99 110.092 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.46 -38.89 88.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.499 -0.773 . . . . 158.17 110.585 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.65 -39.04 96.01 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.536 -0.756 . . . . 65.71 112.615 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.07 96.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.617 0.246 . . . . 95.38 110.802 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -66.25 -41.67 89.66 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.98 0.419 . . . . 381.14 110.335 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.01 -43.41 97.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.931 -0.577 . . . . 182.12 110.796 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -79.08 -2.05 86.42 Favored Glycine 0 CA--C 1.519 0.342 0 CA-C-N 116.022 -0.535 . . . . 88.8 113.43 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -77.38 -31.34 54.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 999.99 110.709 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -103.48 112.55 25.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 999.99 110.152 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.5 mt -128.18 124.01 61.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.367 -0.379 . . . . 308.67 110.059 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -140.46 70.96 1.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.887 0.375 . . . . 388.05 111.097 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 61.8 mtt -70.31 -28.17 64.96 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.969 -0.559 . . . . 360.57 111.19 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.24 82.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.918 -0.583 . . . . 184.23 111.285 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -59.52 -47.82 84.03 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.241 -0.436 . . . . 999.99 110.83 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.42 ' CE2' HG13 ' A' ' 53' ' ' VAL . 43.4 t80 -60.29 -47.76 84.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.345 -0.389 . . . . 374.13 110.304 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -59.83 -47.87 83.96 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.765 -0.652 . . . . 999.99 111.154 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -60.84 -46.7 89.53 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.41 -0.359 . . . . 558.87 111.255 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.83 98.69 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.459 -0.337 . . . . 332.85 111.388 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.25 -44.27 92.29 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.077 -0.51 . . . . 472.21 110.783 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -63.68 -41.91 98.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.673 -0.694 . . . . 821.44 110.952 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.83 -42.83 85.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.09 -0.504 . . . . 746.24 112.171 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -88.43 -7.9 55.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.173 -0.211 . . . . 999.99 111.493 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.04 39.04 31.43 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.081 0.771 . . . . 675.44 113.081 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.15 61.26 1.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.882 0.373 . . . . 999.99 110.743 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.0 mt -82.13 121.7 79.01 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.222 -0.445 . . . . 390.38 110.699 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.94 152.73 63.44 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.563 2.176 . . . . 243.11 112.548 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -74.79 136.3 41.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 618.1 110.767 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -69.58 90.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 999.99 110.963 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.16 145.36 29.87 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.009 -0.541 . . . . 415.25 111.564 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.06 -30.28 47.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.555 2.17 . . . . 529.15 112.35 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -63.29 -45.48 91.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.102 -0.499 . . . . 516.88 110.185 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 98.1 mtp -62.36 -40.24 95.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.927 -0.579 . . . . 914.6 110.164 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.26 -41.6 97.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.535 -0.757 . . . . 675.31 110.535 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.22 -39.42 93.93 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.838 -0.619 . . . . 900.95 110.883 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 90.0 mt -61.51 -44.0 97.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 116.086 -0.506 . . . . 300.73 110.872 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.08 -36.38 83.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 595.29 111.147 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -70.54 -16.12 62.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 999.99 112.229 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 75.1 mtm -69.93 140.07 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.973 -0.291 . . . . 385.68 110.811 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 129' ' ' VAL . 59.6 ttp180 -51.41 129.82 33.57 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.857 -0.611 . . . . 999.99 111.367 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -53.15 -34.74 70.18 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.383 2.722 . . . . 149.6 113.326 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.51 76.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 147.02 111.838 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -91.11 0.48 57.53 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.946 0.35 . . . . 360.37 111.946 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 125' ' ' ARG . 58.4 t -98.19 111.11 58.72 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.715 0.293 . . . . 187.93 111.138 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.39 151.03 82.24 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.084 2.523 . . . . 265.39 112.301 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.98 142.72 32.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.984 0.421 . . . . 246.78 110.704 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -132.78 148.14 52.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.91 -0.586 . . . . 999.99 110.557 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -83.99 173.92 10.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 495.41 110.349 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.237 -0.887 . . . . 761.34 110.921 -178.94 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 112.412 0.523 . . . . 999.99 112.412 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.3 m -145.11 155.29 43.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.932 0.396 . . . . 999.99 111.535 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -116.09 147.42 41.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.033 -0.53 . . . . 999.99 110.794 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -97.5 8.58 44.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 999.99 111.002 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.93 -100.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 999.99 110.484 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.2 t -126.89 127.84 70.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.437 -0.209 . . . . 375.52 110.437 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.76 129.25 65.9 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.599 -0.273 . . . . 999.99 110.311 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.73 130.03 15.28 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.315 2.01 . . . . 436.63 113.258 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -124.84 1.69 8.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 999.99 110.918 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -104.73 8.93 35.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.376 . . . . 999.99 111.81 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.3 mt -56.78 113.7 1.76 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.893 0.378 . . . . 781.6 111.767 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -114.37 115.01 26.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.722 -0.473 . . . . 216.75 109.722 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -61.7 -39.76 92.59 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.474 -0.33 . . . . 902.9 111.74 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -40.41 89.34 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.968 0.413 . . . . 121.35 111.644 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -71.35 -31.39 67.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.095 -0.502 . . . . 265.05 110.492 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -65.14 -41.19 95.03 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.824 -0.626 . . . . 524.44 112.016 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.749 HG11 ' HA ' ' A' ' 127' ' ' ALA . 18.7 m -73.99 -29.83 26.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.731 -0.388 . . . . 214.56 111.455 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.92 -40.04 95.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.561 0.696 . . . . 61.91 109.262 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HA3' ' A' ' 89' ' ' GLY . 61.2 tp -64.64 -39.64 94.06 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.712 -1.131 . . . . 321.59 111.082 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 98.2 mttt -59.58 -40.5 87.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.191 -0.459 . . . . 491.97 111.155 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.537 ' O ' HG22 ' A' ' 24' ' ' ILE . 77.6 t -65.42 -44.32 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.879 0.371 . . . . 179.68 111.199 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -66.12 -42.23 89.47 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.775 0.657 . . . . 483.12 112.775 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 19' ' ' LEU . 44.0 pt -81.42 -27.64 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 113.394 0.887 . . . . 120.91 113.394 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.537 HG22 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -58.43 -35.73 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.534 0.207 . . . . 324.41 111.513 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.66 92.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 76.38 111.237 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.57 -41.74 89.47 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.158 -0.544 . . . . 59.56 112.828 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 37.8 m-85 -71.17 -24.97 62.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.635 0.235 . . . . 169.43 111.635 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.434 ' O ' HG23 ' A' ' 32' ' ' VAL . 34.7 t70 -75.45 -38.84 59.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.719 -0.219 . . . . 145.09 110.899 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.58 -41.28 98.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.924 0.392 . . . . 779.77 110.01 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.81 -39.97 96.99 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.732 -0.667 . . . . 72.33 112.275 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' PHE . 86.4 mt -64.59 -38.81 92.3 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.466 0.173 . . . . 213.67 111.466 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 28' ' ' ASP . 60.6 t -60.25 -46.0 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.67 -0.241 . . . . 275.82 110.878 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -63.59 -40.59 97.33 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.052 0.454 . . . . 545.0 110.389 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CH2' HD11 ' A' ' 42' ' ' LEU . 87.3 t90 -64.49 -42.24 95.97 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.695 -0.684 . . . . 999.99 110.279 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.9 mt -61.98 -36.94 82.99 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.816 -0.629 . . . . 205.93 111.296 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -61.6 -37.61 84.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.708 0.29 . . . . 557.46 111.275 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.4 t -87.35 -50.51 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 113.378 0.881 . . . . 284.57 113.378 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.576 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.13 -29.46 8.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.251 0.834 . . . . 350.44 113.251 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.56 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.7 -35.09 84.93 Favored Glycine 0 N--CA 1.462 0.37 0 CA-C-N 116.588 -0.278 . . . . 199.7 113.793 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -58.2 -39.49 79.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.961 0.356 . . . . 999.99 111.961 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.9 p -87.3 -10.15 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.749 0.648 . . . . 302.8 112.749 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 98.0 mt -73.39 150.98 41.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.134 0.492 . . . . 581.97 111.963 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.4 m -77.08 162.79 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.673 . . . . 239.07 110.565 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.5 m -59.9 -41.13 90.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.216 -0.447 . . . . 192.01 111.187 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.431 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 77.8 t -65.64 -41.71 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.27 -0.423 . . . . 278.45 110.642 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.94 -39.84 95.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.085 -0.507 . . . . 316.42 110.913 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -61.83 -44.25 97.22 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.238 -0.437 . . . . 470.35 110.789 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -39.31 93.84 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.277 -0.42 . . . . 369.78 110.92 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -23.89 66.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.777 -0.647 . . . . 66.79 112.149 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.2 -37.36 82.7 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.285 0.476 . . . . 238.3 112.285 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -59.01 -46.94 86.93 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.157 -0.683 . . . . 526.93 109.157 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -62.21 -44.23 97.04 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.422 -0.808 . . . . 162.88 110.421 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.4 t -61.15 -42.46 93.38 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 CA-C-N 116.451 -0.341 . . . . 139.01 110.492 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.45 -40.33 90.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.229 -0.441 . . . . 198.61 111.051 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -61.15 -46.96 88.38 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.001 -0.37 . . . . 999.99 110.001 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -64.73 -39.37 93.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.375 0.607 . . . . 799.65 110.21 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' A' ' 96' ' ' ILE . 90.9 t80 -58.36 -47.75 82.81 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.121 -0.945 . . . . 151.58 110.586 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.0 ttt -60.48 -45.24 94.48 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 168.43 110.816 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.66 ' HG2' HG13 ' A' ' 131' ' ' VAL . 53.0 mt-30 -62.32 -39.26 92.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 530.56 111.653 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.9 m -60.51 -48.24 82.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.397 -0.365 . . . . 293.49 110.976 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.478 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 82.7 m-70 -70.22 -39.13 75.29 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.425 -0.352 . . . . 383.72 111.204 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -61.4 -45.43 94.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.966 -0.561 . . . . 497.0 111.452 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.28 87.56 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 111.729 0.27 . . . . 177.0 111.729 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -62.78 -46.08 89.66 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.928 0.394 . . . . 478.76 111.129 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.478 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 48.9 m-85 -70.68 -33.82 71.32 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.137 -0.483 . . . . 727.09 111.761 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 1.8 mmt -49.09 -41.33 35.31 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.909 0.707 . . . . 664.46 112.909 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.4 mt -61.96 -43.91 97.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.718 0.294 . . . . 447.74 111.111 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -70.17 -43.93 69.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 999.99 111.051 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 73' ' ' ILE . 97.2 mt -63.65 -47.92 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 115.619 -0.719 . . . . 398.95 111.922 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -62.55 -40.64 97.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.317 -0.401 . . . . 366.97 111.685 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.7 -46.8 89.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.671 -0.24 . . . . 709.01 110.918 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -65.85 -41.79 91.28 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.555 -0.293 . . . . 931.14 111.529 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.9 mm -65.16 -46.38 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.491 -0.322 . . . . 175.26 111.04 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -62.99 -43.61 98.31 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.269 -0.423 . . . . 443.19 111.783 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.26 97.0 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.459 -0.337 . . . . 366.44 111.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.66 -42.62 50.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.028 0.442 . . . . 386.93 111.012 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.89 -14.69 64.56 Favored Glycine 0 CA--C 1.518 0.234 0 CA-C-N 115.845 -0.616 . . . . 244.67 112.431 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -75.57 139.06 41.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.596 0.236 . . . . 999.99 110.85 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 68.7 p -75.36 139.4 71.7 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.747 -0.206 . . . . 263.29 110.653 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.47 142.56 33.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.423 2.082 . . . . 173.89 112.924 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.532 HG23 ' H ' ' A' ' 84' ' ' ASP . 18.6 m -102.87 171.42 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.503 . . . . 201.66 111.095 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 76.8 t -60.78 -42.52 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.305 -0.407 . . . . 81.09 110.52 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.31 96.02 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.957 -0.64 . . . . 106.63 112.234 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.532 ' H ' HG23 ' A' ' 81' ' ' VAL . 38.1 t70 -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.826 0.346 . . . . 397.23 110.178 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 28.2 m-85 -62.96 -41.78 99.63 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.935 -0.575 . . . . 176.41 111.226 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 77.2 p -68.03 -36.37 79.82 Favored 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 111.847 0.314 . . . . 224.32 111.847 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.9 -41.66 95.41 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.032 0.444 . . . . 999.99 110.15 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -69.37 -39.02 78.29 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.629 -0.714 . . . . 158.17 110.205 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.52 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.19 -36.73 93.41 Favored Glycine 0 C--N 1.333 0.365 0 CA-C-N 115.176 -0.92 . . . . 65.71 113.175 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.9 85.08 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.427 0.156 . . . . 95.38 111.209 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.97 -40.66 96.35 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.969 0.414 . . . . 381.14 110.252 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -64.53 -43.58 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.828 -0.624 . . . . 182.12 110.545 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . -64.44 -22.45 67.62 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.719 -0.673 . . . . 88.8 113.95 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.2 -14.2 58.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.034 0.417 . . . . 999.99 111.489 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.75 115.38 29.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.632 0.253 . . . . 999.99 110.866 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.492 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 43.4 pt -129.78 147.44 33.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.996 0.427 . . . . 308.67 111.241 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -148.08 34.98 0.82 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.0 -0.546 . . . . 388.05 110.976 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.9 mmm -61.95 -39.5 92.32 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.189 -0.46 . . . . 360.57 111.382 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.7 88.98 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.174 -0.466 . . . . 184.23 111.104 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -68.94 -30.94 69.49 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.756 -0.656 . . . . 999.99 111.666 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.78 -49.65 76.88 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.751 0.31 . . . . 374.13 110.833 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -66.87 -37.14 83.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.462 -0.335 . . . . 999.99 111.309 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.97 -44.46 97.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.415 -0.357 . . . . 558.87 110.385 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.18 -41.65 99.24 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.029 -0.532 . . . . 332.85 111.114 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.05 -41.49 90.74 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.07 -0.514 . . . . 472.21 110.754 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -62.55 -41.12 98.69 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.119 -0.491 . . . . 821.44 110.65 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.56 -40.2 78.36 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.975 -0.557 . . . . 746.24 111.314 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.2 -4.42 59.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.313 -0.403 . . . . 999.99 111.04 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 57.64 39.85 27.15 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.851 -0.613 . . . . 675.44 111.428 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 98.7 mmm -108.36 114.25 27.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.424 -0.353 . . . . 999.99 111.321 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.1 mt -94.44 118.99 66.96 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 390.38 109.831 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.72 126.72 12.31 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.019 1.812 . . . . 243.11 113.053 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -87.11 156.41 19.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.768 -0.651 . . . . 618.1 110.774 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.431 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 75.4 t80 -67.27 125.92 27.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.025 -0.361 . . . . 999.99 110.025 178.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.3 mt -98.62 138.08 20.71 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.535 -0.302 . . . . 415.25 111.363 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.84 -23.17 55.48 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.655 2.237 . . . . 529.15 111.861 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -63.84 -30.17 71.29 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.559 -0.746 . . . . 516.88 110.822 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.6 mtt -60.13 -39.16 85.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.962 -0.563 . . . . 914.6 110.66 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -61.09 -40.87 95.35 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.215 -0.448 . . . . 675.31 110.69 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.27 -41.11 97.07 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.137 -0.483 . . . . 900.95 111.069 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.98 -44.53 99.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.351 -0.386 . . . . 300.73 110.816 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.54 -39.63 94.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.392 -0.367 . . . . 595.29 111.632 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -68.01 -33.43 74.6 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.206 0.447 . . . . 999.99 112.206 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -83.33 130.45 35.06 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.08 0.4 . . . . 385.68 112.08 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -53.6 145.66 28.41 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 115.731 -0.668 . . . . 999.99 111.117 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -27.47 84.92 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.609 2.206 . . . . 149.6 112.618 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.749 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -71.07 -19.75 62.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 147.02 111.29 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -103.5 12.69 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.334 -0.394 . . . . 360.37 111.194 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.4 t -98.82 110.43 57.33 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.834 0.35 . . . . 187.93 110.696 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.94 166.59 26.58 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.091 2.527 . . . . 265.39 112.957 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.66 HG13 ' HG2' ' A' ' 59' ' ' GLN . 64.7 t -107.37 136.33 42.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.047 -0.723 . . . . 246.78 109.047 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -115.67 131.11 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.875 0.369 . . . . 999.99 110.191 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -76.53 158.58 31.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.304 0.573 . . . . 495.41 112.21 -178.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 74.3 mmm . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.264 -0.874 . . . . 761.34 111.526 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 112.731 0.641 . . . . 999.99 112.731 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m -118.96 13.7 13.11 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.488 0.551 . . . . 999.99 112.488 -178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.6 38.91 2.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.911 0.386 . . . . 999.99 111.491 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.8 m80 57.49 -125.78 1.72 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.563 -0.744 . . . . 999.99 111.751 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -108.53 13.63 25.2 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.705 0.261 . . . . 999.99 111.705 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.8 t -100.58 115.43 42.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.086 0.47 . . . . 375.52 110.456 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -89.82 119.61 69.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.948 -0.569 . . . . 999.99 110.217 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.99 137.76 82.54 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.537 2.158 . . . . 436.63 112.386 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -106.81 -67.1 0.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 999.99 111.601 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -105.43 4.27 30.5 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.024 0.379 . . . . 999.99 112.024 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.64 125.25 22.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.58 -0.282 . . . . 781.6 110.957 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -99.53 112.02 24.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.339 . . . . 216.75 110.632 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -61.89 -39.67 92.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.795 -0.639 . . . . 902.9 111.354 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.81 80.03 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.367 -0.379 . . . . 121.35 111.983 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -64.09 -36.06 82.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.414 -0.357 . . . . 265.05 110.123 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 79.2 mm-40 -64.87 -40.39 95.04 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.921 -0.581 . . . . 524.44 110.078 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.4 -47.65 92.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 115.654 -0.703 . . . . 214.56 111.631 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -40.67 97.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 61.91 111.049 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.763 HD22 ' HB3' ' A' ' 85' ' ' TYR . 60.1 tp -65.57 -41.74 92.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.903 -0.59 . . . . 321.59 111.615 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG12 ' A' ' 24' ' ' ILE . 57.1 mtmt -60.24 -38.64 84.06 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.589 -0.278 . . . . 491.97 111.488 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.4 t -63.39 -43.68 98.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.635 0.255 . . . . 179.68 110.349 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -65.7 -40.39 92.23 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.365 -0.38 . . . . 483.12 110.708 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -42.41 94.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.94 -0.573 . . . . 120.91 110.915 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 20' ' ' LYS . 26.9 mm -60.07 -42.79 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.069 -0.514 . . . . 324.41 111.328 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.29 -42.97 96.6 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 111.559 0.207 . . . . 76.38 111.559 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.98 -44.3 96.15 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.744 -0.741 . . . . 59.56 112.848 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -73.03 -20.41 61.0 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.77 0.285 . . . . 169.43 111.77 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -75.63 -39.54 57.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.041 -0.355 . . . . 145.09 110.041 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -63.95 -42.0 97.43 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.328 -0.619 . . . . 779.77 109.328 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.469 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -64.53 -39.78 97.1 Favored Glycine 0 CA--C 1.52 0.374 0 CA-C-N 115.551 -0.749 . . . . 72.33 112.282 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 66.5 tp -59.19 -46.3 88.78 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.181 0.437 . . . . 213.67 112.181 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -27.08 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 120.835 -0.346 . . . . 275.82 111.883 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -63.86 -40.71 97.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.826 0.346 . . . . 545.0 110.937 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 2.7 m-90 -78.4 -31.77 48.44 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.773 0.321 . . . . 999.99 111.184 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 91.7 mt -63.02 -39.81 95.88 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.2 -0.454 . . . . 205.93 111.681 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -71.04 -19.31 62.51 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.886 0.328 . . . . 557.46 111.886 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.3 t -85.84 -44.88 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.734 0.302 . . . . 284.57 111.767 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -100.46 9.62 42.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.758 0.313 . . . . 350.44 111.547 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.25 -19.63 70.53 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.127 -0.488 . . . . 199.7 114.199 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.552 ' HG3' HG23 ' A' ' 41' ' ' THR . 52.0 ptt85 -64.15 -34.42 78.02 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.177 0.488 . . . . 999.99 112.226 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.552 HG23 ' HG3' ' A' ' 40' ' ' ARG . 58.5 p -114.05 -0.13 14.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.855 0.359 . . . . 302.8 111.79 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -72.31 124.95 26.17 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 581.97 111.836 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.9 m -77.82 158.91 29.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 239.07 110.705 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -60.67 -43.35 97.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.871 0.367 . . . . 192.01 111.203 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.604 HG13 ' HB2' ' A' ' 114' ' ' TYR . 67.3 t -66.62 -41.65 88.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.096 -0.502 . . . . 278.45 110.824 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 97.1 mt-30 -62.95 -39.54 94.96 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.967 -0.56 . . . . 316.42 111.511 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.05 -47.32 86.37 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.627 0.251 . . . . 470.35 111.105 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -65.21 -39.55 92.94 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.848 0.356 . . . . 369.78 110.858 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.92 86.55 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.838 -0.619 . . . . 66.79 111.363 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.0 mt -61.31 -36.42 80.06 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.042 -0.527 . . . . 238.3 112.244 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -59.54 -41.17 89.45 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.676 -0.49 . . . . 526.93 109.676 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -67.26 -41.44 85.54 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.864 -0.607 . . . . 162.88 110.039 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.79 -42.94 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.97 -0.559 . . . . 139.01 110.502 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -60.07 -42.78 95.29 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.078 -0.51 . . . . 198.61 110.539 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -63.32 -42.67 99.0 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.328 -0.396 . . . . 999.99 110.567 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -63.95 -43.08 96.88 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.138 0.494 . . . . 799.65 110.242 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -60.32 -47.35 86.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.335 -0.848 . . . . 151.58 110.51 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttp -60.0 -44.16 94.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.666 -0.697 . . . . 168.43 110.851 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.62 -41.51 99.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.113 -0.494 . . . . 530.56 110.976 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.0 m -62.5 -47.06 85.6 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.287 -0.415 . . . . 293.49 111.231 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -64.37 -47.07 80.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.041 -0.527 . . . . 383.72 110.75 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -62.82 -47.73 82.14 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.345 0.498 . . . . 497.0 112.345 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.79 78.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.784 0.661 . . . . 177.0 112.784 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.99 -50.36 74.38 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 121.223 -0.191 . . . . 478.76 111.341 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -73.02 -41.06 64.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.731 0.3 . . . . 727.09 111.209 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.4 tmm? -54.71 -47.32 73.87 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.709 -0.678 . . . . 664.46 112.327 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.3 mt -61.35 -41.09 96.49 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 111.928 0.344 . . . . 447.74 111.928 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -62.51 -47.9 81.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 999.99 111.494 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.6 tt -78.47 -32.19 16.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.621 0.6 . . . . 398.95 112.621 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -60.95 -41.5 96.42 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.63 0.252 . . . . 366.97 111.225 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -60.68 -45.98 92.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 709.01 110.254 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.17 -43.03 93.02 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.907 -0.588 . . . . 931.14 111.474 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.34 -46.36 95.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-O 120.785 0.326 . . . . 175.26 111.394 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.45 -45.1 94.62 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.168 -0.469 . . . . 443.19 111.27 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.3 95.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.438 -0.346 . . . . 366.44 111.81 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.48 -38.48 81.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.557 -0.292 . . . . 386.93 111.502 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.22 6.92 70.64 Favored Glycine 0 CA--C 1.518 0.259 0 C-N-CA 120.772 -0.728 . . . . 244.67 112.465 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -74.04 151.23 40.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.846 0.355 . . . . 999.99 110.981 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.7 p -114.91 95.08 40.4 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 263.29 111.238 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -72.31 155.79 55.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.731 2.287 . . . . 173.89 112.66 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.5 m -100.3 175.49 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 201.66 111.445 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.0 t -60.19 -40.88 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.147 -0.479 . . . . 81.09 111.193 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.4 -39.69 95.13 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.842 -0.694 . . . . 106.63 112.475 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.31 -40.18 95.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.022 0.439 . . . . 397.23 110.347 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.763 ' HB3' HD22 ' A' ' 19' ' ' LEU . 42.8 m-85 -68.47 -39.19 81.48 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.68 -0.691 . . . . 176.41 111.838 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.9 p -66.42 -29.66 69.85 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.835 0.309 . . . . 224.32 111.835 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -63.57 -42.14 98.35 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.01 0.433 . . . . 999.99 110.056 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.26 -41.0 74.05 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.812 -0.631 . . . . 158.17 110.493 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.09 -40.4 99.17 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.417 -0.811 . . . . 65.71 112.95 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.44 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.57 -41.97 98.16 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.432 0.158 . . . . 95.38 111.301 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.93 -41.86 97.51 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.936 0.398 . . . . 381.14 110.55 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 92.8 mt -65.27 -42.9 95.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.768 -0.651 . . . . 182.12 110.912 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.32 -20.92 65.88 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 116.019 -0.537 . . . . 88.8 113.544 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 95.7 mtt-85 -79.44 -17.54 54.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.916 0.358 . . . . 999.99 111.42 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -108.71 110.93 22.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.885 0.374 . . . . 999.99 110.88 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.8 mt -129.39 125.55 62.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.831 -0.433 . . . . 308.67 109.831 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -122.46 51.56 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.976 0.417 . . . . 388.05 110.999 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.4 ptm -91.96 -9.73 41.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.123 -0.49 . . . . 360.57 111.837 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.47 95.91 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.837 0.351 . . . . 184.23 111.753 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -70.06 -28.24 65.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.465 . . . . 999.99 111.247 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -58.2 -46.57 85.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.339 -0.391 . . . . 374.13 111.217 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.608 0.242 . . . . 999.99 111.11 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.5 -45.3 69.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.349 -0.387 . . . . 558.87 110.908 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.17 96.07 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.98 -0.554 . . . . 332.85 111.816 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.38 -47.89 84.13 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.421 -0.354 . . . . 472.21 110.83 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -64.27 -40.25 95.61 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.272 -0.422 . . . . 821.44 111.102 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.09 -39.05 80.99 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.001 -0.545 . . . . 746.24 112.16 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -83.0 -11.94 57.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 111.66 0.244 . . . . 999.99 111.66 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.8 t30 52.56 48.64 22.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.027 0.441 . . . . 675.44 111.391 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 19.2 mmt -122.98 102.67 8.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.369 -0.378 . . . . 999.99 110.84 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.2 mt -93.93 117.57 67.21 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.492 -0.322 . . . . 390.38 110.326 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.36 149.48 50.78 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.439 2.093 . . . . 243.11 112.846 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -84.59 147.16 27.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 618.1 110.227 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.604 ' HB2' HG13 ' A' ' 45' ' ' VAL . 76.5 t80 -66.77 123.04 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 999.99 110.689 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 85.6 mt -98.89 120.73 57.97 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.083 -0.508 . . . . 415.25 111.447 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.67 -28.45 81.62 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.025 2.484 . . . . 529.15 112.37 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.49 -29.0 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.704 -0.68 . . . . 516.88 111.709 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 66.6 mtt -60.01 -39.21 85.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.568 -0.287 . . . . 914.6 110.758 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.41 -40.72 95.42 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.176 -0.465 . . . . 675.31 110.936 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -62.12 -44.38 96.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.174 -0.466 . . . . 900.95 110.966 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.51 -45.09 99.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.353 -0.385 . . . . 300.73 111.11 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -63.09 -40.89 98.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.251 -0.431 . . . . 595.29 112.007 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -66.35 -33.71 76.33 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.383 0.512 . . . . 999.99 112.383 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.8 mtm -80.25 136.98 36.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.789 0.328 . . . . 385.68 111.665 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.496 ' O ' HG23 ' A' ' 129' ' ' VAL . 77.3 mtp85 -53.4 144.12 32.9 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 115.815 -0.63 . . . . 999.99 111.165 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -52.89 -33.95 63.89 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.233 2.622 . . . . 149.6 113.061 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.79 -36.37 78.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 147.02 111.809 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.45 -0.51 57.63 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.972 0.36 . . . . 360.37 111.972 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.9 t -91.7 114.61 62.48 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.705 0.288 . . . . 187.93 111.022 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.04 157.9 50.3 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.653 2.235 . . . . 265.39 112.352 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 m -120.61 155.89 23.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.299 -0.41 . . . . 246.78 110.761 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -98.26 119.59 37.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.025 0.441 . . . . 999.99 111.381 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -84.37 155.69 22.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.767 -0.651 . . . . 495.41 109.911 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.261 -0.876 . . . . 761.34 111.051 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 ttt-85 . . . . . 0 N--CA 1.464 0.24 0 N-CA-C 110.004 -0.369 . . . . 999.99 110.004 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 m -84.11 74.34 10.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.891 0.377 . . . . 999.99 110.365 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 5.8 t-105 -108.15 -178.38 3.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 999.99 110.614 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.475 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 11.3 t-160 -66.92 135.99 54.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.324 -0.398 . . . . 999.99 110.354 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -105.74 8.15 32.81 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 111.805 0.298 . . . . 999.99 111.805 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.475 ' HB ' ' CE1' ' A' ' 4' ' ' HIS . 65.2 t -113.2 121.9 66.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 375.52 110.413 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.99 156.07 72.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.424 . . . . 999.99 110.986 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.32 151.37 65.84 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.464 2.109 . . . . 436.63 112.323 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.52 ' HG3' ' CD1' ' A' ' 10' ' ' PHE . 22.5 tptm -104.0 123.57 47.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 999.99 110.305 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.52 ' CD1' ' HG3' ' A' ' 9' ' ' LYS . 75.3 m-85 59.01 39.4 23.53 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.575 0.547 . . . . 999.99 111.683 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -56.99 120.02 7.26 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.869 0.366 . . . . 781.6 111.278 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -114.3 123.35 49.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.322 -0.399 . . . . 216.75 110.154 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -61.87 -39.48 92.06 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.399 -0.364 . . . . 902.9 111.213 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.75 -38.41 81.66 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.144 -0.48 . . . . 121.35 111.616 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -71.25 -25.48 62.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 265.05 111.438 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.08 -40.11 96.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.276 -0.42 . . . . 524.44 112.115 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -72.82 -27.19 24.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 120.782 -0.367 . . . . 214.56 111.633 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.87 93.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.326 0.584 . . . . 61.91 109.631 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.405 HD13 ' CZ2' ' A' ' 62' ' ' TRP . 56.8 mt -64.08 -41.16 97.41 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.123 -0.944 . . . . 321.59 111.206 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.41 -40.15 93.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.992 -0.549 . . . . 491.97 111.788 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.6 t -64.51 -45.95 94.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.582 -0.281 . . . . 179.68 111.51 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.86 -41.15 75.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.958 0.355 . . . . 483.12 111.958 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.403 ' O ' ' HD1' ' A' ' 27' ' ' PHE . 96.7 mt -66.95 -44.8 88.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.404 -0.362 . . . . 120.91 111.933 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.2 tt -63.18 -32.74 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 111.964 0.357 . . . . 324.41 111.964 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.66 -45.95 92.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.407 -0.36 . . . . 76.38 111.457 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.18 -41.94 91.73 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.753 -0.737 . . . . 59.56 112.617 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 43.8 m-85 -70.27 -28.05 64.91 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.74 0.274 . . . . 169.43 111.74 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -40.99 46.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.436 -0.209 . . . . 145.09 110.436 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -62.85 -44.56 95.81 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.622 -0.51 . . . . 779.77 109.622 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -38.64 96.65 Favored Glycine 0 C--N 1.335 0.489 0 CA-C-N 115.464 -0.789 . . . . 72.33 112.226 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 tp -64.09 -42.96 96.73 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.736 0.303 . . . . 213.67 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.51 -45.26 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.983 -0.553 . . . . 275.82 110.598 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -62.5 -40.59 97.2 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.838 0.351 . . . . 545.0 110.473 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -63.13 -43.95 96.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.995 -0.548 . . . . 999.99 110.033 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' HG3' ' A' ' 47' ' ' LYS . 85.8 mt -62.46 -37.93 87.85 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.698 -0.683 . . . . 205.93 111.214 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.71 -37.74 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.688 0.28 . . . . 557.46 111.579 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.6 t -87.33 -50.66 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 113.525 0.935 . . . . 284.57 113.525 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.9 m80 -101.9 -27.56 12.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.022 0.749 . . . . 350.44 113.022 -177.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.566 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -72.08 -11.7 75.0 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.07 -0.586 . . . . 199.7 113.401 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -60.85 -39.92 90.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.819 0.303 . . . . 999.99 111.819 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 76.6 p -97.85 -8.13 28.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.246 0.461 . . . . 302.8 112.246 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.566 HD12 ' HA2' ' A' ' 39' ' ' GLY . 97.2 mt -73.11 150.7 42.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.064 0.459 . . . . 581.97 111.819 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 m -72.72 161.86 30.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.753 -0.658 . . . . 239.07 110.642 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -59.48 -40.1 85.86 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.109 -0.496 . . . . 192.01 111.12 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HB2' ' A' ' 114' ' ' TYR . 55.8 t -65.15 -43.46 95.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.415 . . . . 278.45 110.852 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.88 -39.96 94.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.269 -0.423 . . . . 316.42 111.054 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG3' HD22 ' A' ' 35' ' ' LEU . 87.8 tttt -61.32 -47.18 87.13 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.277 -0.419 . . . . 470.35 110.795 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.41 -38.61 90.46 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.277 -0.419 . . . . 369.78 111.399 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.53 86.07 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.126 -0.488 . . . . 66.79 111.608 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -60.11 -30.67 69.42 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.171 -0.468 . . . . 238.3 111.99 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -62.35 -41.2 98.4 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.631 0.253 . . . . 526.93 110.769 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -66.58 -41.01 89.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.112 0.482 . . . . 162.88 110.122 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.481 HG22 HH21 ' A' ' 56' ' ' ARG . 62.6 t -60.86 -41.31 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 115.418 -0.81 . . . . 139.01 110.502 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.79 -42.15 88.35 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.928 -0.578 . . . . 198.61 110.506 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -63.28 -44.57 94.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.511 -0.313 . . . . 999.99 110.975 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.481 HH21 HG22 ' A' ' 53' ' ' VAL . 80.7 mtm180 -65.27 -42.41 93.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.989 0.423 . . . . 799.65 111.168 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -62.05 -44.43 96.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.535 -0.757 . . . . 151.58 110.499 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 9.0 ttp -59.4 -40.88 88.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.864 -0.607 . . . . 168.43 110.744 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.19 -42.54 99.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.169 -0.469 . . . . 530.56 111.365 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 134' ' ' MET . 75.4 p -71.39 -37.87 71.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.806 0.336 . . . . 293.49 111.116 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -63.99 -44.86 91.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.034 -0.53 . . . . 383.72 109.683 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.405 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 38.6 t-105 -61.74 -45.47 93.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.367 -0.833 . . . . 497.0 111.918 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.41 77.99 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.511 0.56 . . . . 177.0 112.511 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -62.13 -41.49 98.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.722 0.267 . . . . 478.76 111.722 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -82.52 -33.73 28.15 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.623 -0.262 . . . . 727.09 111.527 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.2 ttp -53.17 -43.93 67.46 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.988 -0.551 . . . . 664.46 112.02 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 98.1 mt -60.87 -41.41 95.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.295 -0.411 . . . . 447.74 111.339 -178.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -69.03 -39.74 79.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.473 -0.331 . . . . 999.99 111.299 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.95 -45.34 99.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.038 -0.528 . . . . 398.95 111.349 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -62.33 -37.13 84.45 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.235 -0.439 . . . . 366.97 112.103 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -60.89 -42.89 98.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.631 0.253 . . . . 709.01 110.931 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -67.41 -42.46 83.23 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.358 -0.383 . . . . 931.14 111.419 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.93 -47.04 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.307 -0.406 . . . . 175.26 111.168 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -63.05 -43.95 97.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.161 -0.472 . . . . 443.19 111.452 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.47 -40.77 98.0 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.471 -0.331 . . . . 366.44 111.859 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.1 mt -70.26 -41.34 73.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.953 0.406 . . . . 386.93 111.278 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.52 -10.61 71.13 Favored Glycine 0 CA--C 1.52 0.36 0 CA-C-N 116.05 -0.523 . . . . 244.67 112.779 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.5 mpt_? -75.22 149.25 38.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.672 0.273 . . . . 999.99 111.347 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 74.9 p -72.24 138.48 81.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.387 -0.37 . . . . 263.29 110.585 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.0 136.99 23.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.291 1.994 . . . . 173.89 112.748 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 84' ' ' ASP . 14.7 m -104.37 155.14 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.243 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 79.6 t -63.58 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.17 -0.468 . . . . 81.09 111.169 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.63 97.7 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.745 -0.741 . . . . 106.63 112.608 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.522 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.2 t70 -64.38 -41.14 96.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.156 0.503 . . . . 397.23 109.807 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -63.0 -42.41 99.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.316 -0.856 . . . . 176.41 111.324 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -67.74 -36.2 80.13 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.9 -0.32 . . . . 224.32 110.932 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -62.83 -46.48 87.75 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.003 0.43 . . . . 999.99 110.01 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.27 -41.23 94.42 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.747 -0.661 . . . . 158.17 110.792 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.06 -41.07 99.67 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-N 115.97 -0.559 . . . . 65.71 112.413 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -62.26 -40.13 95.19 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.605 0.24 . . . . 95.38 110.95 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -66.98 -40.8 87.49 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.063 0.459 . . . . 381.14 110.467 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.5 mt -64.71 -41.5 92.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.562 -0.745 . . . . 182.12 111.031 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.09 -11.77 59.25 Favored Glycine 0 CA--C 1.52 0.384 0 CA-C-N 115.969 -0.559 . . . . 88.8 113.694 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 79.5 mtp85 -80.19 -10.96 59.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.069 0.434 . . . . 999.99 111.239 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.2 mmt85 -108.42 129.3 55.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.924 0.392 . . . . 999.99 110.925 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.83 -76.87 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.438 . . . . 308.67 111.093 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.1 t0 55.79 49.01 17.01 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.999 0.428 . . . . 388.05 111.649 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.6 mtm -86.52 -2.34 58.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.244 -0.435 . . . . 360.57 111.531 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.15 89.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.172 -0.467 . . . . 184.23 111.919 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -62.89 -39.02 93.2 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.257 -0.429 . . . . 999.99 111.868 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.485 ' CE2' HD11 ' A' ' 105' ' ' LEU . 86.7 t80 -58.97 -47.19 86.01 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.821 0.343 . . . . 374.13 110.736 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -59.75 -47.68 84.69 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.002 -0.544 . . . . 999.99 110.733 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.42 -39.21 89.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.039 -0.528 . . . . 558.87 110.931 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.41 95.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.152 -0.476 . . . . 332.85 111.317 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.485 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.24 -43.02 99.78 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.606 -0.27 . . . . 472.21 110.692 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.7 -44.39 93.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.226 -0.443 . . . . 821.44 110.721 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.45 -43.26 88.75 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.777 -0.647 . . . . 746.24 111.769 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -87.91 -5.16 58.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.385 -0.371 . . . . 999.99 111.647 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.16 43.68 26.37 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.935 0.494 . . . . 675.44 111.187 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.1 103.75 13.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.318 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -94.59 117.81 66.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.007 -0.542 . . . . 390.38 110.334 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.43 138.68 33.15 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.29 1.993 . . . . 243.11 112.887 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -86.27 144.27 27.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.935 -0.575 . . . . 618.1 110.957 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.607 ' HB2' HG13 ' A' ' 45' ' ' VAL . 47.0 t80 -68.95 99.17 1.03 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.728 0.299 . . . . 999.99 111.214 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.9 mt -98.74 123.34 50.06 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.419 -0.355 . . . . 415.25 110.975 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.81 -34.27 84.43 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.165 2.576 . . . . 529.15 112.479 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.98 -43.87 94.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.901 -0.59 . . . . 516.88 111.334 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.77 -41.14 90.4 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.474 -0.33 . . . . 914.6 110.535 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -61.77 -42.1 98.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.958 -0.565 . . . . 675.31 110.327 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.48 -43.42 98.86 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.003 -0.544 . . . . 900.95 111.452 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.578 HG23 HG21 ' A' ' 129' ' ' VAL . 34.6 mm -61.91 -46.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.76 0.314 . . . . 300.73 111.001 178.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -62.5 -40.8 97.89 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.098 -0.501 . . . . 595.29 111.378 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 67.4 ttp85 -64.86 -34.84 79.32 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.188 -0.46 . . . . 999.99 111.826 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.9 mtp -72.89 134.49 44.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.949 0.404 . . . . 385.68 111.753 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -53.85 145.05 33.57 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.517 -0.765 . . . . 999.99 111.3 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.57 -38.5 83.88 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.969 2.446 . . . . 149.6 112.942 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.45 75.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.572 . . . . 147.02 112.114 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -90.03 -15.0 32.71 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.205 0.817 . . . . 360.37 113.205 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.578 HG21 HG23 ' A' ' 121' ' ' ILE . 9.0 p -105.03 130.95 22.26 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 120.501 -0.479 . . . . 187.93 111.441 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -61.3 147.24 96.08 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.816 2.344 . . . . 265.39 112.491 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.2 m -126.3 152.31 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.211 -0.45 . . . . 246.78 110.394 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -118.84 127.7 53.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 999.99 110.992 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -84.49 80.54 9.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.037 -0.529 . . . . 495.41 110.478 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.605 ' HB2' HG22 ' A' ' 60' ' ' THR . 97.6 mtp . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.1 -0.953 . . . . 761.34 111.106 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 . . . . . 0 N--CA 1.463 0.214 0 CA-C-O 121.034 0.445 . . . . 999.99 111.07 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.9 m -92.42 45.28 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.125 -0.489 . . . . 999.99 112.025 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.59 ' HD1' HD21 ' A' ' 67' ' ' LEU . 21.3 t90 -62.2 -45.9 91.32 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.099 0.476 . . . . 999.99 110.461 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -84.12 64.53 8.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.098 -0.501 . . . . 999.99 110.867 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -123.23 -70.04 0.79 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 999.99 110.02 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.4 t -123.47 123.06 66.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 375.52 109.83 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.07 149.18 65.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 110.411 -0.218 . . . . 999.99 110.411 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.82 136.04 37.34 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.085 1.857 . . . . 436.63 112.367 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -120.63 -38.81 2.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.586 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -103.1 2.39 34.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.791 0.293 . . . . 999.99 111.791 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.1 tp -57.91 124.12 18.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.754 0.312 . . . . 781.6 110.743 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -113.26 120.1 40.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 216.75 110.495 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -62.1 -37.95 87.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 902.9 111.068 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.24 82.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.191 -0.458 . . . . 121.35 111.587 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -77.74 -20.39 53.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 265.05 110.976 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.39 -42.56 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 524.44 111.612 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.02 -32.55 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 120.961 -0.296 . . . . 214.56 111.685 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.57 -44.32 96.63 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.114 0.483 . . . . 61.91 110.252 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HB3' ' A' ' 85' ' ' TYR . 90.9 mt -69.51 -38.2 77.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.475 -0.784 . . . . 321.59 111.329 178.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -59.03 -41.92 88.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.548 -0.751 . . . . 491.97 111.794 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.01 -44.69 99.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.527 0.204 . . . . 179.68 111.116 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.88 -40.78 91.92 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.82 0.343 . . . . 483.12 111.148 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.72 -42.78 95.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.913 -0.585 . . . . 120.91 111.503 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 86.8 mt -60.21 -42.5 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.391 -0.368 . . . . 324.41 111.621 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.87 94.89 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.079 -0.248 . . . . 76.38 111.42 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -66.61 -40.69 94.16 Favored Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.876 -0.678 . . . . 59.56 112.578 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -73.12 -18.34 61.3 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 122.762 0.425 . . . . 169.43 112.009 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.04 -38.96 61.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.787 0.291 . . . . 145.09 111.787 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 26' ' ' GLY . 16.7 ptm180 -66.19 -32.3 73.65 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 120.516 -0.474 . . . . 779.77 110.11 179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.96 -39.16 97.72 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 115.683 -0.69 . . . . 72.33 112.138 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 54' ' ' ASN . 84.2 mt -63.77 -39.28 93.87 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.55 0.214 . . . . 213.67 110.876 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.496 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 69.6 t -61.03 -46.73 96.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.16 -0.473 . . . . 275.82 111.095 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -64.23 -41.5 96.97 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.908 0.385 . . . . 545.0 110.979 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.56 ' O ' HG12 ' A' ' 37' ' ' VAL . 76.5 t90 -65.46 -43.33 90.7 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.404 0.621 . . . . 999.99 110.39 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 42' ' ' LEU . 48.0 tp -61.46 -33.19 73.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.187 -0.915 . . . . 205.93 112.487 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 32' ' ' VAL . 99.4 mtt180 -58.24 -28.49 64.95 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.38 0.881 . . . . 557.46 113.38 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 34' ' ' TRP . 8.6 p -84.5 -26.33 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.667 -0.413 . . . . 284.57 112.022 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -111.2 15.28 21.58 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.65 0.262 . . . . 350.44 111.257 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -39.81 97.81 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.066 -0.515 . . . . 199.7 114.293 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.53 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -65.12 -23.23 67.08 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.606 0.595 . . . . 999.99 112.606 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.53 HG23 ' HG3' ' A' ' 40' ' ' ARG . 44.6 p -112.83 11.65 19.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.046 0.387 . . . . 302.8 112.046 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 35' ' ' LEU . 56.6 tp -71.9 122.49 20.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 581.97 112.041 -179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 71.1 m -80.53 159.21 25.58 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.963 -0.562 . . . . 239.07 110.033 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -61.73 -43.77 98.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.659 0.266 . . . . 192.01 111.639 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -73.22 -31.22 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 111.7 0.259 . . . . 278.45 111.7 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -62.8 -38.54 91.09 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.784 0.29 . . . . 316.42 111.784 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -59.77 -46.26 89.74 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.732 0.301 . . . . 470.35 110.388 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.42 -39.0 91.6 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.221 -0.445 . . . . 369.78 110.396 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.53 -36.54 80.84 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.549 -0.75 . . . . 66.79 111.849 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.21 -36.68 78.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.372 -0.376 . . . . 238.3 111.904 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -61.22 -39.61 90.9 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.471 -0.566 . . . . 526.93 109.471 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.72 -39.84 88.18 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.757 -0.656 . . . . 162.88 109.776 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 63.2 t -60.11 -39.15 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.142 0 CA-C-N 115.741 -0.663 . . . . 139.01 110.461 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.583 ' HB2' HD11 ' A' ' 31' ' ' LEU . 13.5 t30 -56.88 -47.05 81.37 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.327 -0.397 . . . . 198.61 110.799 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.97 -40.56 91.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.664 -0.244 . . . . 999.99 110.756 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -62.07 -45.49 93.28 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.056 0.455 . . . . 799.65 110.111 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -60.44 -47.04 87.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.571 -0.74 . . . . 151.58 110.157 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -46.9 88.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 168.43 111.474 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.499 ' HG2' HG23 ' A' ' 131' ' ' VAL . 77.5 mt-30 -62.85 -43.44 98.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.005 0.372 . . . . 530.56 112.005 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.3 p -71.57 -40.42 69.95 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.797 0.295 . . . . 293.49 111.797 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.435 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 61.1 t-80 -64.13 -47.56 79.47 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.875 0.369 . . . . 383.72 110.548 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -63.74 -44.15 94.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.747 -0.661 . . . . 497.0 112.081 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.64 83.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.796 0.665 . . . . 177.0 112.796 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -64.62 -40.89 96.29 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.921 0.341 . . . . 478.76 111.921 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 79.8 m-85 -81.49 -26.78 34.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.757 0.28 . . . . 727.09 111.757 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.5 ttp -52.54 -41.6 63.67 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.051 -0.522 . . . . 664.46 112.072 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.59 HD21 ' HD1' ' A' ' 3' ' ' TRP . 4.0 mm? -58.78 -44.61 90.7 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.663 -0.244 . . . . 447.74 111.494 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.6 m0 -67.36 -41.15 85.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 999.99 110.818 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 47.5 mm -67.37 -45.41 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 115.95 -0.568 . . . . 398.95 111.047 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.16 -41.93 97.65 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.949 -0.569 . . . . 366.97 111.47 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -60.18 -45.55 92.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.435 -0.348 . . . . 709.01 110.63 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.62 -42.66 95.36 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.402 -0.363 . . . . 931.14 111.269 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -63.8 -46.92 93.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.813 0.34 . . . . 175.26 111.164 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.43 -40.81 97.77 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.257 -0.429 . . . . 443.19 111.312 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.46 95.92 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.374 -0.375 . . . . 366.44 111.419 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.1 mt -69.77 -40.47 76.05 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.341 -0.39 . . . . 386.93 111.341 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 -8.22 79.59 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.044 -0.598 . . . . 244.67 112.507 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -74.76 153.06 38.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 999.99 111.707 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -108.53 95.96 17.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.008 -0.542 . . . . 263.29 110.651 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.89 147.61 55.96 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.552 2.168 . . . . 173.89 113.282 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -101.07 -175.37 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.615 -0.721 . . . . 201.66 111.142 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.3 t -58.77 -41.97 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.404 -0.362 . . . . 81.09 110.718 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.615 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.57 -40.62 98.1 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.658 -0.782 . . . . 106.63 112.181 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.15 -40.58 90.7 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 397.23 110.692 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.52 ' HB3' HD11 ' A' ' 19' ' ' LEU . 33.3 m-85 -69.18 -36.26 77.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.705 -0.68 . . . . 176.41 112.174 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.615 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.8 OUTLIER -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.638 0.236 . . . . 224.32 111.638 -179.089 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.21 -46.34 89.35 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.722 -0.473 . . . . 999.99 109.722 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.71 -39.82 84.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.582 -0.735 . . . . 158.17 110.423 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.66 99.2 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 115.717 -0.674 . . . . 65.71 112.436 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.77 -41.22 97.42 Favored 'General case' 0 C--N 1.335 -0.064 0 CA-C-O 120.745 0.307 . . . . 95.38 110.498 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.48 -40.06 95.46 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.039 -0.528 . . . . 381.14 110.596 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 37.4 mm -63.28 -43.65 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.948 -0.569 . . . . 182.12 110.383 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 -20.61 66.84 Favored Glycine 0 CA--C 1.521 0.457 0 CA-C-N 115.873 -0.603 . . . . 88.8 113.609 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 42.0 mmt180 -79.73 -16.12 56.22 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.939 0.369 . . . . 999.99 111.384 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 -107.7 111.72 24.06 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.015 -0.365 . . . . 999.99 110.015 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -125.44 125.33 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.412 -0.358 . . . . 308.67 110.164 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.6 70.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.986 0.422 . . . . 388.05 110.888 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.82 -29.01 66.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.885 -0.598 . . . . 360.57 110.764 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.03 79.88 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.532 -0.758 . . . . 184.23 111.405 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.44 -46.98 85.45 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.113 -0.494 . . . . 999.99 111.064 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.27 -48.17 81.29 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.781 0.324 . . . . 374.13 110.728 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.69 -47.96 83.92 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.995 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -62.2 -39.08 91.55 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.055 -0.52 . . . . 558.87 111.609 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.47 94.57 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.384 -0.371 . . . . 332.85 111.265 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 90.2 mt -63.33 -40.83 98.37 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.304 -0.407 . . . . 472.21 110.667 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -64.7 -40.18 94.93 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.008 -0.542 . . . . 821.44 110.903 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.32 -43.36 88.16 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.882 -0.599 . . . . 746.24 111.525 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt -87.19 -6.92 58.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.472 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 56.42 37.24 28.65 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.956 0.502 . . . . 675.44 111.334 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.8 ttp -116.89 117.37 29.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 999.99 111.311 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.75 119.54 65.96 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.051 -0.522 . . . . 390.38 110.224 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.07 138.87 87.91 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.515 2.143 . . . . 243.11 112.33 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -85.49 119.52 25.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.414 -0.357 . . . . 618.1 110.966 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -70.01 89.84 0.62 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.068 -0.514 . . . . 999.99 110.562 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 86.4 mt -97.8 141.93 23.76 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 112.006 0.372 . . . . 415.25 112.006 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.4 Cg_exo -58.6 -33.04 97.88 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.237 2.625 . . . . 529.15 112.575 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -59.72 -44.54 93.68 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.077 -0.51 . . . . 516.88 111.203 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 65.6 mtt -60.51 -40.2 90.55 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.798 -0.445 . . . . 914.6 109.798 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.94 -40.57 96.0 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.619 -0.718 . . . . 675.31 110.444 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.14 -39.79 94.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.694 -0.685 . . . . 900.95 111.072 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.3 mt -61.09 -43.64 96.67 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.434 -0.348 . . . . 300.73 110.73 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.77 -37.78 83.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.258 -0.428 . . . . 595.29 110.336 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -64.11 -33.39 75.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.64 . . . . 999.99 110.758 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 69.6 mtm -68.47 140.0 55.72 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.462 -0.335 . . . . 385.68 110.956 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.472 ' O ' HG23 ' A' ' 129' ' ' VAL . 55.6 mmm-85 -52.46 137.48 41.09 Favored Pre-proline 0 N--CA 1.465 0.302 0 CA-C-N 115.892 -0.595 . . . . 999.99 111.51 178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -35.13 79.01 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.316 2.677 . . . . 149.6 113.229 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.1 77.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 147.02 112.106 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.75 -1.98 57.83 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.87 0.322 . . . . 360.37 111.87 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 125' ' ' ARG . 68.7 t -98.59 115.75 65.66 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.679 0.276 . . . . 187.93 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.57 156.09 61.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.671 2.247 . . . . 265.39 112.473 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.499 HG23 ' HG2' ' A' ' 59' ' ' GLN . 3.5 p -106.89 139.78 27.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 246.78 110.448 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -107.87 131.88 54.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.057 0.456 . . . . 999.99 110.879 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -83.95 156.71 22.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.848 -0.614 . . . . 495.41 110.733 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.2 mmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.425 -0.798 . . . . 761.34 111.045 -179.6 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 . . . . . 0 N--CA 1.471 0.613 0 CA-C-O 120.644 0.259 . . . . 999.99 111.661 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.446 ' HB2' HD21 ' A' ' 67' ' ' LEU . 41.3 m -115.7 89.94 3.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.032 0.444 . . . . 999.99 110.872 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.7 m-90 -101.97 21.8 14.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.283 -0.417 . . . . 999.99 110.837 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -89.58 -3.5 58.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 999.99 111.292 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -107.57 -59.3 1.85 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.985 0.422 . . . . 999.99 110.269 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.0 m -131.11 152.15 37.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.928 -0.578 . . . . 375.52 110.234 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.05 149.82 70.61 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.881 0.372 . . . . 999.99 111.376 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.25 161.21 45.15 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.052 2.501 . . . . 436.63 113.076 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.0 mttp 67.42 17.32 10.1 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.428 -0.805 . . . . 999.99 112.258 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -62.28 -50.09 73.08 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.079 0.466 . . . . 999.99 110.378 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.06 139.84 56.43 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.411 -0.813 . . . . 781.6 111.245 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -61.69 129.83 42.95 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.396 -0.365 . . . . 216.75 110.293 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -63.24 -20.34 65.36 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.556 0.576 . . . . 902.9 112.556 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.3 -39.09 81.91 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.75 0.309 . . . . 121.35 111.632 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -68.37 -30.45 69.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 265.05 110.885 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.25 -39.68 94.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 524.44 110.76 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.6 -48.98 86.26 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-N 116.148 -0.478 . . . . 214.56 111.386 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.25 -41.69 99.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.023 -0.535 . . . . 61.91 111.433 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 85' ' ' TYR . 51.6 tp -66.5 -41.42 88.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 321.59 111.392 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -59.28 -35.24 73.4 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.952 -0.567 . . . . 491.97 112.054 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.17 -44.15 98.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.822 0.344 . . . . 179.68 110.291 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -69.97 -38.57 76.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.961 0.41 . . . . 483.12 110.465 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.8 mt -61.05 -47.09 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.765 0.654 . . . . 120.91 112.765 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 32.9 pt -60.26 -36.22 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 112.775 0.657 . . . . 324.41 112.775 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.91 -46.22 90.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.665 0.269 . . . . 76.38 111.361 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.67 -41.14 89.95 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 121.138 -0.554 . . . . 59.56 112.888 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -73.62 -21.09 60.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.268 . . . . 169.43 111.704 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 32' ' ' VAL . 16.3 t70 -77.12 -40.23 46.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.684 -0.235 . . . . 145.09 110.705 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.07 -42.38 99.65 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.001 0.429 . . . . 779.77 109.954 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -65.48 -39.59 95.74 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.639 -0.709 . . . . 72.33 111.773 178.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.9 -41.62 98.12 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 115.64 -0.28 . . . . 213.67 110.768 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 28' ' ' ASP . 64.4 t -60.72 -42.77 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.18 -0.464 . . . . 275.82 111.115 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -61.39 -41.56 97.32 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.608 -0.269 . . . . 545.0 111.21 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.558 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 1.8 m-90 -74.24 -37.3 63.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.036 0.446 . . . . 999.99 110.94 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.3 tp -64.31 -41.85 96.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.945 -0.571 . . . . 205.93 112.039 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -66.18 -23.0 66.38 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.192 0.812 . . . . 557.46 113.192 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.1 m -98.21 -20.0 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 112.991 0.737 . . . . 284.57 112.991 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -109.35 -27.41 9.52 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.879 -0.328 . . . . 350.44 111.666 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.95 -26.33 60.65 Favored Glycine 0 C--N 1.331 0.265 0 CA-C-N 115.801 -0.636 . . . . 199.7 114.38 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' HG3' HG23 ' A' ' 41' ' ' THR . 12.3 ptp85 -66.4 -22.49 66.23 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.558 0.679 . . . . 999.99 111.36 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 40' ' ' ARG . 66.1 p -112.55 -20.67 11.65 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.234 0.457 . . . . 302.8 112.234 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.1 mt -73.09 147.32 45.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.122 0.487 . . . . 581.97 112.093 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -75.97 163.62 26.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 239.07 109.75 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.3 m -58.88 -42.31 89.2 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.826 0.346 . . . . 192.01 110.893 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.55 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.2 t -66.09 -42.23 91.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.311 -0.404 . . . . 278.45 110.581 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.25 -40.21 96.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.147 -0.479 . . . . 316.42 111.455 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.14 -41.99 99.39 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.661 0.267 . . . . 470.35 110.83 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.37 -39.25 85.65 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.005 0.431 . . . . 369.78 110.374 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 118' ' ' MET . . . -61.7 -36.16 80.1 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.556 -0.747 . . . . 66.79 111.105 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.78 -38.91 79.57 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.751 -0.659 . . . . 238.3 111.193 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -60.7 -40.52 92.52 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.836 0.35 . . . . 526.93 110.343 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -65.85 -40.65 91.91 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.92 -0.582 . . . . 162.88 109.968 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.82 -41.13 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 115.5 -0.773 . . . . 139.01 110.872 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -59.13 -42.73 91.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.312 -0.404 . . . . 198.61 110.598 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -65.03 -41.81 94.89 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.824 0.345 . . . . 999.99 110.519 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -63.41 -43.93 96.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.914 -0.585 . . . . 799.65 110.619 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -59.81 -48.34 82.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.704 -0.68 . . . . 151.58 111.039 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -61.16 -44.22 97.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.423 -0.353 . . . . 168.43 111.109 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.3 -43.21 99.34 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.113 0.412 . . . . 530.56 112.113 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.2 p -71.61 -41.16 69.26 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.959 -0.296 . . . . 293.49 111.571 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -63.22 -46.77 85.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.179 0.514 . . . . 383.72 110.179 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -63.83 -38.7 92.09 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.291 -0.868 . . . . 497.0 111.826 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.79 74.65 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.727 0.269 . . . . 177.0 111.727 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.87 -44.08 97.53 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.792 0.33 . . . . 478.76 110.302 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -70.6 -36.19 73.39 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.129 -0.487 . . . . 727.09 111.254 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 75.9 mmm -51.7 -35.22 41.93 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.065 -0.516 . . . . 664.46 112.261 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.446 HD21 ' HB2' ' A' ' 2' ' ' SER . 65.1 tp -59.29 -50.03 75.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.613 0.244 . . . . 447.74 111.168 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -69.45 -40.1 77.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.354 -0.385 . . . . 999.99 111.394 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.7 mm -64.78 -46.05 93.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.987 -0.551 . . . . 398.95 111.51 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.51 -43.09 99.67 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.368 -0.378 . . . . 366.97 111.23 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.59 -41.94 98.3 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.522 -0.308 . . . . 709.01 110.933 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.73 -47.1 85.02 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 931.14 110.83 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.69 -45.92 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.131 -0.486 . . . . 175.26 110.942 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.45 -45.1 94.58 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.227 -0.442 . . . . 443.19 111.684 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.66 98.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.654 -0.248 . . . . 366.44 111.594 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.4 tp -68.13 -45.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.152 0.501 . . . . 386.93 110.592 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.03 -23.02 31.27 Favored Glycine 0 C--N 1.331 0.278 0 CA-C-N 115.708 -0.678 . . . . 244.67 112.789 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -76.54 141.79 41.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.602 0.239 . . . . 999.99 110.932 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.3 p -82.0 134.41 49.71 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.579 -0.282 . . . . 263.29 110.702 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 154.95 46.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.66 2.24 . . . . 173.89 112.745 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.544 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.3 m -101.72 158.04 4.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.346 -0.388 . . . . 201.66 110.1 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.09 -45.0 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.391 -0.368 . . . . 81.09 111.97 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.459 ' O ' HG22 ' A' ' 86' ' ' THR . . . -61.26 -44.42 98.11 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.633 -0.794 . . . . 106.63 113.553 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.544 ' H ' HG23 ' A' ' 81' ' ' VAL . 33.5 t70 -71.22 -41.62 69.95 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.956 0.378 . . . . 397.23 111.491 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 19' ' ' LEU . 40.1 t80 -65.23 -39.68 93.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.094 -0.503 . . . . 176.41 111.582 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -60.46 -24.11 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.461 -0.336 . . . . 224.32 111.891 -179.604 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -62.41 -37.16 84.72 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.79 0.329 . . . . 999.99 110.887 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.67 -38.96 89.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.909 -0.587 . . . . 158.17 111.17 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.18 -39.3 96.97 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.916 -0.583 . . . . 65.71 113.101 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.09 98.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.633 0.254 . . . . 95.38 111.078 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.79 -40.09 95.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.116 -0.493 . . . . 381.14 110.85 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.5 mm -65.13 -42.71 95.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.772 -0.649 . . . . 182.12 110.953 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.54 -20.16 65.52 Favored Glycine 0 CA--C 1.52 0.388 0 CA-C-N 116.015 -0.539 . . . . 88.8 113.603 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -78.65 -24.52 45.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.037 0.418 . . . . 999.99 111.849 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.85 112.15 24.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 999.99 111.352 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.5 pt -134.69 153.47 35.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.325 -0.398 . . . . 308.67 110.757 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -147.17 55.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.053 0.454 . . . . 388.05 110.608 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.0 mtm -69.32 -28.81 66.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.78 -0.646 . . . . 360.57 111.711 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.558 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -60.14 -40.16 88.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.286 -0.415 . . . . 184.23 111.717 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.15 -41.55 97.14 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.554 -0.293 . . . . 999.99 111.126 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -64.11 -43.89 93.94 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.697 -0.483 . . . . 374.13 109.697 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -60.11 -47.45 85.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.555 -0.748 . . . . 999.99 110.413 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -61.39 -40.51 94.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 558.87 110.694 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.04 96.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.094 -0.503 . . . . 332.85 111.37 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.92 -42.94 99.96 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.655 -0.248 . . . . 472.21 110.587 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -64.36 -42.99 95.92 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.029 -0.532 . . . . 821.44 110.932 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -57.97 -43.45 86.48 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.843 -0.617 . . . . 746.24 111.912 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -89.38 -4.91 57.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.547 -0.297 . . . . 999.99 111.47 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.5 t30 56.74 41.11 28.66 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.11 0.564 . . . . 675.44 111.226 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.3 mmm -108.04 101.76 10.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 999.99 111.342 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 76.1 mt -94.48 118.38 66.96 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.134 -0.485 . . . . 390.38 110.119 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.65 135.75 69.43 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.529 2.152 . . . . 243.11 112.754 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.49 143.37 28.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.202 -0.454 . . . . 618.1 110.673 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.55 ' HB2' HG13 ' A' ' 45' ' ' VAL . 27.8 t80 -68.86 108.05 3.31 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.903 0.382 . . . . 999.99 110.638 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.69 146.51 31.74 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.176 -0.465 . . . . 415.25 111.133 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -57.15 -38.38 95.61 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.886 2.391 . . . . 529.15 112.082 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -62.17 -39.43 92.67 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.64 -0.709 . . . . 516.88 110.871 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttm -58.34 -46.38 86.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.103 -0.499 . . . . 914.6 110.236 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.12 -43.67 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.448 . . . . 675.31 110.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 124' ' ' MET . 96.6 mt-10 -65.14 -42.08 94.16 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.111 0.782 . . . . 900.95 113.111 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.484 HG22 ' O ' ' A' ' 118' ' ' MET . 15.3 tt -64.64 -28.68 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 111.816 0.302 . . . . 300.73 111.816 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -63.48 -35.82 81.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.875 0.369 . . . . 595.29 111.005 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.54 -1.67 57.82 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.862 -0.608 . . . . 999.99 112.239 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 66.1 mtt -88.18 128.88 35.45 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.719 0.295 . . . . 385.68 111.573 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.529 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.5 mmt180 -53.51 142.52 40.57 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 115.939 -0.573 . . . . 999.99 110.758 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.46 -36.93 71.85 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.101 2.534 . . . . 149.6 113.283 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.17 -35.65 77.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 147.02 111.926 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -91.64 1.22 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.493 0.553 . . . . 360.37 112.493 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.4 t -90.34 113.02 55.97 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 187.93 110.965 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.67 157.25 40.04 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.812 2.341 . . . . 265.39 112.761 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.75 157.55 30.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.361 -0.381 . . . . 246.78 110.398 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -132.08 145.86 51.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.059 0.457 . . . . 999.99 111.326 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.89 168.05 15.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 495.41 111.031 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.167 -0.92 . . . . 761.34 110.949 179.945 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 . . . . . 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 999.99 110.19 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 m -87.31 -11.06 50.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.512 -0.313 . . . . 999.99 111.807 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.86 102.08 7.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.64 0.257 . . . . 999.99 110.871 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.06 2.07 40.04 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.889 0.329 . . . . 999.99 111.889 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.07 -68.35 0.83 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.769 0.318 . . . . 999.99 111.813 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.05 154.92 41.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 375.52 110.897 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.4 147.32 63.77 Favored Pre-proline 0 C--O 1.234 0.277 0 CA-C-N 116.39 -0.368 . . . . 999.99 110.55 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.82 148.35 40.91 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.763 2.308 . . . . 436.63 113.299 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -73.76 135.32 43.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.808 -0.633 . . . . 999.99 109.652 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -77.85 93.29 4.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.419 . . . . 999.99 110.793 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.68 142.41 45.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.522 -0.763 . . . . 781.6 111.831 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 64.6 t30 -66.47 132.58 48.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.784 -0.45 . . . . 216.75 109.784 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.07 -40.52 93.99 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.657 -0.247 . . . . 902.9 111.655 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.426 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -60.29 -39.82 88.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 121.35 111.521 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -73.21 -28.37 62.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.208 -0.451 . . . . 265.05 111.004 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 12' ' ' ASN . 96.4 mt-10 -63.88 -39.96 95.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.296 0.48 . . . . 524.44 112.296 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 14' ' ' ALA . 34.6 m -69.57 -34.1 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 120.674 -0.41 . . . . 214.56 111.491 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.94 95.05 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.248 0.547 . . . . 61.91 110.277 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.413 HD11 ' HA3' ' A' ' 89' ' ' GLY . 59.0 tp -69.34 -40.53 77.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.15 -0.932 . . . . 321.59 111.677 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 24' ' ' ILE . 65.0 tttm -59.74 -39.48 84.91 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.846 -0.616 . . . . 491.97 112.309 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.54 -43.7 98.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.396 0.141 . . . . 179.68 111.019 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.89 -41.53 97.69 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.721 0.296 . . . . 483.12 110.855 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.468 HG21 ' SD ' ' A' ' 58' ' ' MET . 97.1 mt -63.3 -44.55 99.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.063 -0.517 . . . . 120.91 110.873 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 20' ' ' LYS . 36.2 mm -60.68 -43.04 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 324.41 111.37 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.49 -42.84 97.14 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.8 -0.182 . . . . 76.38 111.397 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.97 -41.85 98.49 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.88 -0.676 . . . . 59.56 112.761 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -73.6 -23.8 59.97 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.885 0.328 . . . . 169.43 111.885 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -78.54 -30.17 46.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.464 -0.335 . . . . 145.09 111.427 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -62.79 -42.25 99.62 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.85 0.357 . . . . 779.77 110.83 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.96 -26.76 52.45 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.673 -0.775 . . . . 72.33 112.457 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.9 tp -65.55 -43.09 90.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.486 0.184 . . . . 213.67 111.393 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.36 -33.71 65.31 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 C-N-CA 121.015 -0.274 . . . . 275.82 111.336 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.62 -40.61 95.79 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 121.334 0.588 . . . . 545.0 109.701 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -64.91 -41.75 95.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.168 -0.923 . . . . 999.99 109.588 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.86 -37.04 83.01 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.228 -0.896 . . . . 205.93 111.146 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -62.43 -37.13 84.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.615 0.245 . . . . 557.46 111.42 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.86 -50.06 14.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 113.424 0.898 . . . . 284.57 113.424 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -107.51 -29.74 9.03 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -69.19 -13.01 66.65 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.093 -0.575 . . . . 199.7 113.82 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.437 ' HG3' HG23 ' A' ' 41' ' ' THR . 40.8 ptt180 -64.09 -22.04 66.77 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.87 0.335 . . . . 999.99 111.708 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.437 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.0 p -105.88 -15.35 14.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.953 0.406 . . . . 302.8 111.525 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -73.63 148.76 42.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 581.97 111.546 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -76.97 167.21 22.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.995 -0.548 . . . . 239.07 110.57 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -64.7 -32.07 73.58 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.987 0.366 . . . . 192.01 111.987 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.427 HG12 ' HB3' ' A' ' 114' ' ' TYR . 0.4 OUTLIER -69.03 -39.77 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.958 0.408 . . . . 278.45 110.198 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.545 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 90.1 mt-30 -64.99 -41.32 95.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.829 -0.623 . . . . 316.42 110.879 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.27 -45.33 92.0 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.078 -0.51 . . . . 470.35 110.785 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.27 -38.45 91.08 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.716 -0.675 . . . . 369.78 110.823 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.02 85.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.887 -0.597 . . . . 66.79 111.528 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.411 ' HA ' HG22 ' A' ' 53' ' ' VAL . 88.2 mt -62.24 -38.18 88.25 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.414 -0.357 . . . . 238.3 111.558 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -63.05 -39.01 93.45 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.306 -0.627 . . . . 526.93 109.306 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -62.12 -48.06 81.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.344 -0.844 . . . . 162.88 111.608 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.425 HG21 ' CE2' ' A' ' 101' ' ' PHE . 17.2 m -68.89 -24.16 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 C-N-CA 121.016 -0.273 . . . . 139.01 111.679 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.88 -41.37 91.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.53 -0.304 . . . . 198.61 110.569 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -62.96 -41.92 99.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.491 -0.322 . . . . 999.99 110.448 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -63.93 -44.03 94.1 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.166 0.507 . . . . 799.65 110.036 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -60.13 -47.47 85.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.226 -0.897 . . . . 151.58 111.113 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.468 ' SD ' HG21 ' A' ' 23' ' ' ILE . 47.0 ttp -59.33 -45.46 91.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.995 -0.548 . . . . 168.43 111.068 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.658 ' HG2' HG13 ' A' ' 131' ' ' VAL . 56.5 mt-30 -64.7 -41.47 95.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.476 -0.329 . . . . 530.56 111.139 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -66.09 -45.5 80.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.22 -0.446 . . . . 293.49 110.787 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -64.38 -42.36 96.19 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.036 -0.529 . . . . 383.72 110.548 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.43 ' HB2' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -60.11 -41.38 92.44 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.607 -0.724 . . . . 497.0 111.827 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.07 91.26 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.378 0.51 . . . . 177.0 112.378 -178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -62.55 -47.84 82.12 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.984 0.421 . . . . 478.76 111.014 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.418 ' HE2' HD22 ' A' ' 88' ' ' LEU . 55.7 t80 -68.46 -44.35 75.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.916 -0.584 . . . . 727.09 111.188 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 62' ' ' TRP . 0.0 OUTLIER -52.18 -39.11 59.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.566 -0.743 . . . . 664.46 112.893 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.39 -41.62 94.19 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.885 0.328 . . . . 447.74 111.885 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -68.09 -40.47 82.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.977 0.418 . . . . 999.99 110.69 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.429 ' O ' HG12 ' A' ' 73' ' ' ILE . 48.7 mm -70.62 -41.25 77.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.709 -0.678 . . . . 398.95 111.293 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -58.94 -40.95 86.2 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.033 -0.53 . . . . 366.97 111.694 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.91 -43.5 98.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.859 0.361 . . . . 709.01 110.541 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -66.58 -44.92 80.92 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.817 -0.629 . . . . 931.14 110.938 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.2 mm -64.38 -45.01 97.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 115.831 -0.622 . . . . 175.26 111.452 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -61.02 -43.79 98.36 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.309 -0.405 . . . . 443.19 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.21 -40.35 97.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.392 -0.367 . . . . 366.44 111.445 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -70.28 -40.54 74.27 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.422 -0.354 . . . . 386.93 111.486 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.63 -8.0 80.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.962 -0.637 . . . . 244.67 112.688 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -74.64 148.82 40.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 999.99 111.588 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.6 p -103.77 106.24 51.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 263.29 110.94 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 33.0 Cg_exo -60.91 143.88 99.45 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.138 2.559 . . . . 173.89 113.348 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -100.49 -175.78 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 201.66 110.996 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.39 -42.9 89.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-N 116.414 -0.357 . . . . 81.09 110.856 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.536 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -40.43 98.18 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.825 -0.702 . . . . 106.63 112.506 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -64.19 -42.26 96.75 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.851 0.357 . . . . 397.23 110.835 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 48.2 m-85 -71.16 -35.8 71.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.061 -0.518 . . . . 176.41 111.644 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.536 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -62.43 -35.93 80.8 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.575 0.226 . . . . 224.32 110.779 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -63.56 -45.03 92.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.248 0.547 . . . . 999.99 109.98 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.418 HD22 ' HE2' ' A' ' 65' ' ' TYR . 98.0 mt -65.82 -40.66 92.03 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.47 -0.786 . . . . 158.17 110.483 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.413 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.87 -39.48 98.07 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 115.687 -0.688 . . . . 65.71 112.779 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.7 90.07 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.631 0.253 . . . . 95.38 111.198 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.83 -41.84 97.76 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.27 -0.423 . . . . 381.14 110.421 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.89 -42.26 91.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.744 -0.662 . . . . 182.12 111.171 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.49 -9.16 64.3 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.928 -0.578 . . . . 88.8 113.691 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.31 -30.4 54.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.906 0.384 . . . . 999.99 110.86 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -100.89 120.63 40.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 999.99 110.421 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 80.9 mt -116.48 119.72 62.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.528 -0.306 . . . . 308.67 110.773 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -110.97 24.66 12.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.299 -0.409 . . . . 388.05 111.946 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.7 mmm -61.71 -39.1 90.32 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.602 0.239 . . . . 360.57 111.28 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -39.25 90.13 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.035 0.445 . . . . 184.23 110.798 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -66.05 -35.98 82.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.026 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.425 ' CE2' HG21 ' A' ' 53' ' ' VAL . 87.5 t80 -58.9 -48.95 79.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.329 -0.396 . . . . 374.13 110.514 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -61.01 -47.8 84.74 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.922 -0.581 . . . . 999.99 110.798 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.56 -39.62 91.77 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.8 -0.636 . . . . 558.87 111.776 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.26 98.49 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.551 -0.295 . . . . 332.85 111.393 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 91.0 mt -64.79 -40.81 95.85 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.384 -0.371 . . . . 472.21 110.722 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.43 -43.68 96.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.892 -0.595 . . . . 821.44 111.096 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.85 -40.12 83.31 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.122 -0.49 . . . . 746.24 112.023 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -89.01 -7.24 56.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.587 -0.279 . . . . 999.99 111.287 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 52.9 t30 58.43 32.41 22.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.826 -0.625 . . . . 675.44 111.258 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 22.4 mmt -107.31 98.5 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 999.99 111.063 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.0 mt -94.24 119.67 66.3 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.022 -0.535 . . . . 390.38 110.514 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.36 150.85 65.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.454 2.102 . . . . 243.11 112.163 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -84.8 118.31 24.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.842 0.353 . . . . 618.1 110.56 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.545 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 23.7 m-85 -70.33 107.71 3.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.84 -0.618 . . . . 999.99 111.043 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.72 143.5 26.33 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.605 -0.271 . . . . 415.25 111.264 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -58.25 -35.07 99.07 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.071 2.514 . . . . 529.15 112.933 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -63.02 -34.18 77.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.25 -0.432 . . . . 516.88 111.027 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 95.8 mtp -60.17 -40.07 88.64 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.884 0.373 . . . . 914.6 110.129 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.03 -39.9 93.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.755 -0.657 . . . . 675.31 110.183 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 124' ' ' MET . 88.5 tt0 -62.92 -41.68 99.55 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.608 -0.723 . . . . 900.95 111.146 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.56 -42.37 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.813 0.34 . . . . 300.73 110.724 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.87 -38.57 82.54 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.08 -0.509 . . . . 595.29 111.129 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -77.71 -9.66 59.11 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.336 0.495 . . . . 999.99 112.336 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 68.1 mtt -71.54 139.22 49.39 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.653 0.264 . . . . 385.68 111.107 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -52.33 136.13 41.14 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.904 -0.589 . . . . 999.99 111.263 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -54.31 -36.88 88.13 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.039 2.493 . . . . 149.6 113.079 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.411 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -64.3 -25.48 68.07 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.3 -0.409 . . . . 147.02 111.851 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -92.03 -1.77 57.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.455 -0.339 . . . . 360.37 111.383 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 60.1 t -99.94 112.98 64.93 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.669 -0.241 . . . . 187.93 110.745 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.23 152.58 61.73 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.501 2.134 . . . . 265.39 112.347 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.658 HG13 ' HG2' ' A' ' 59' ' ' GLN . 96.7 t -124.38 135.8 62.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 246.78 110.275 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -133.28 134.71 44.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.385 -0.371 . . . . 999.99 110.419 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -84.74 92.46 8.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.981 0.42 . . . . 495.41 110.371 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.282 -0.866 . . . . 761.34 111.345 -179.706 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 120.773 0.32 . . . . 999.99 110.501 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.0 m -114.5 115.54 27.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.899 -0.408 . . . . 999.99 109.899 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -93.84 -5.12 48.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.461 -0.336 . . . . 999.99 111.836 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -90.84 113.12 25.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 999.99 110.776 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -68.39 -39.77 81.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.107 -0.497 . . . . 999.99 110.607 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.478 ' HB ' ' OD1' ' A' ' 70' ' ' ASN . 73.1 t -124.15 128.51 74.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 375.52 109.852 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -81.36 125.15 79.67 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.597 -0.274 . . . . 999.99 110.826 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.72 151.73 63.81 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.698 2.265 . . . . 436.63 112.788 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -132.76 134.89 45.31 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 999.99 109.722 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 63.81 33.67 12.55 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.582 0.551 . . . . 999.99 111.49 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -56.26 120.45 7.61 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.257 -0.429 . . . . 781.6 110.953 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -91.48 106.49 18.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.43 -0.35 . . . . 216.75 111.055 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.32 -22.11 66.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.93 -0.577 . . . . 902.9 111.819 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.44 81.43 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.804 0.335 . . . . 121.35 111.488 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -63.4 -37.29 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 265.05 109.98 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.76 -39.37 93.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.745 -0.661 . . . . 524.44 110.419 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.59 -46.92 95.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.812 -0.631 . . . . 214.56 111.285 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.01 99.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.22 -0.445 . . . . 61.91 111.256 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 85' ' ' TYR . 91.0 mt -67.21 -37.98 84.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.838 -0.619 . . . . 321.59 111.306 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.15 -39.7 83.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.736 -0.665 . . . . 491.97 111.586 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 74.1 t -62.82 -44.26 99.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.606 0.241 . . . . 179.68 110.657 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.82 -40.22 91.63 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.939 0.4 . . . . 483.12 110.744 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.07 -41.98 94.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.748 -0.66 . . . . 120.91 111.317 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.5 mt -60.05 -43.15 92.05 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.49 -0.323 . . . . 324.41 111.193 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -43.98 97.36 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.598 0.237 . . . . 76.38 111.228 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.48 -40.18 96.08 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.068 -0.587 . . . . 59.56 112.495 178.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -72.78 -20.49 61.16 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.384 0.273 . . . . 169.43 111.489 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.37 -36.42 60.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.535 -0.302 . . . . 145.09 110.557 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -60.84 -44.12 97.4 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.329 -0.619 . . . . 779.77 109.329 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.63 -39.07 97.43 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.475 -0.784 . . . . 72.33 112.215 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 83.2 mt -62.14 -40.51 96.19 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.458 0.171 . . . . 213.67 111.058 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.4 t -60.96 -43.97 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.191 -0.459 . . . . 275.82 110.702 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.72 -44.6 96.42 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.147 -0.479 . . . . 545.0 111.02 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -68.03 -38.42 82.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.925 0.393 . . . . 999.99 110.179 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.6 mt -62.17 -37.0 83.56 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.929 -0.578 . . . . 205.93 111.611 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -61.87 -37.12 83.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.601 0.238 . . . . 557.46 111.543 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.5 t -87.82 -52.5 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 113.502 0.926 . . . . 284.57 113.502 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -115.36 -5.74 12.32 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.244 0.831 . . . . 350.44 113.244 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.94 -37.86 93.27 Favored Glycine 0 N--CA 1.46 0.282 0 C-N-CA 121.29 -0.481 . . . . 199.7 113.685 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.405 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.8 ptm180 -62.01 -18.66 61.26 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.265 0.468 . . . . 999.99 112.265 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.405 HG23 ' HG3' ' A' ' 40' ' ' ARG . 73.5 p -106.15 1.07 25.9 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.409 0.522 . . . . 302.8 112.409 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.424 HD12 ' HA2' ' A' ' 39' ' ' GLY . 86.8 mt -72.27 141.22 48.91 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.0 0.429 . . . . 581.97 111.962 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.0 m -77.78 162.77 26.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.746 -0.661 . . . . 239.07 110.495 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.9 m -60.02 -42.39 94.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.818 0.342 . . . . 192.01 110.96 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.617 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.7 t -65.89 -41.96 91.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.125 -0.488 . . . . 278.45 110.799 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.15 -40.91 98.94 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.21 -0.45 . . . . 316.42 111.178 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 64.2 tttm -61.47 -45.7 93.13 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.386 -0.37 . . . . 470.35 110.924 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.03 -38.72 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 369.78 111.019 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.21 -22.94 66.34 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.729 -0.668 . . . . 66.79 112.433 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -53.85 -36.27 62.4 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.384 0.512 . . . . 238.3 112.384 -179.303 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -62.41 -41.21 98.51 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.796 0.331 . . . . 526.93 110.785 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -70.43 -37.61 74.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 162.88 110.22 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.34 -41.22 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.669 -0.696 . . . . 139.01 111.014 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -59.99 -39.79 86.96 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.778 -0.192 . . . . 198.61 110.943 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -61.62 -46.15 91.04 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.789 0.328 . . . . 999.99 110.235 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -63.28 -41.72 99.03 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.979 -0.555 . . . . 799.65 110.61 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -61.77 -41.52 97.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.568 -0.742 . . . . 151.58 110.036 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 98.2 mtp -64.97 -38.55 91.32 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.961 -0.563 . . . . 168.43 111.364 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.03 -40.9 95.36 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.833 0.679 . . . . 530.56 112.833 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.471 ' HA ' ' SD ' ' A' ' 134' ' ' MET . 75.8 p -68.46 -38.85 81.48 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.694 -0.402 . . . . 293.49 111.371 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.474 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 69.9 m80 -70.7 -40.13 73.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.351 -0.386 . . . . 383.72 111.206 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.423 ' HH2' HD13 ' A' ' 19' ' ' LEU . 30.7 m95 -63.85 -39.84 95.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 497.0 112.206 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.73 90.65 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.828 0.307 . . . . 177.0 111.828 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -65.04 -46.86 79.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.828 0.347 . . . . 478.76 111.486 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.492 ' O ' HG12 ' A' ' 69' ' ' ILE . 62.7 m-85 -70.54 -40.52 73.35 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.346 -0.388 . . . . 727.09 112.025 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 17.7 tpt -53.76 -50.13 66.71 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.184 0.438 . . . . 664.46 112.184 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.95 -39.96 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.957 0.354 . . . . 447.74 111.957 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -61.99 -47.88 82.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 999.99 111.67 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.7 pt -80.11 -24.63 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.43 0.53 . . . . 398.95 112.43 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.478 ' OD1' ' HB ' ' A' ' 6' ' ' VAL . 28.6 t-20 -58.73 -45.52 89.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.613 0.227 . . . . 366.97 111.613 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.23 -41.73 96.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.548 -0.296 . . . . 709.01 111.237 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -70.06 -42.7 72.51 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.135 0.42 . . . . 931.14 112.135 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.83 -46.62 95.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.578 0.228 . . . . 175.26 111.433 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.58 -46.89 86.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.465 -0.334 . . . . 443.19 111.757 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.51 -41.16 96.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.171 0.434 . . . . 366.44 112.171 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.13 -40.6 71.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.875 0.369 . . . . 386.93 111.594 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.1 -8.23 78.93 Favored Glycine 0 CA--C 1.52 0.36 0 C-N-CA 121.042 -0.599 . . . . 244.67 112.287 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.8 mmt-85 -75.22 150.65 38.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.944 0.402 . . . . 999.99 111.546 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 p -107.42 100.98 36.86 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 263.29 110.634 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.516 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 46.0 Cg_exo -59.51 140.98 96.58 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.022 2.481 . . . . 173.89 113.398 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.29 -175.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.766 -0.652 . . . . 201.66 111.115 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.6 t -59.31 -41.6 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 116.375 -0.375 . . . . 81.09 110.909 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.577 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.38 -40.68 97.88 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.815 -0.707 . . . . 106.63 112.536 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -70.1 -42.29 72.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.018 0.437 . . . . 397.23 110.803 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.723 ' HB3' HD11 ' A' ' 19' ' ' LEU . 26.5 m-85 -68.0 -34.13 75.94 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.809 -0.632 . . . . 176.41 112.687 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -56.03 -32.57 64.13 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.686 0.254 . . . . 224.32 111.686 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -62.48 -45.42 93.11 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.05 0.453 . . . . 999.99 109.982 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.3 mt -66.12 -40.78 90.94 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.695 -0.684 . . . . 158.17 110.559 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.53 -40.64 99.37 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.661 -0.699 . . . . 65.71 112.364 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.91 -40.01 94.0 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.521 0.201 . . . . 95.38 110.836 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -63.44 -40.12 96.31 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.213 -0.449 . . . . 381.14 110.567 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.73 -42.69 96.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.996 -0.547 . . . . 182.12 110.517 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.33 -10.44 66.12 Favored Glycine 0 CA--C 1.522 0.488 0 CA-C-N 115.689 -0.687 . . . . 88.8 113.747 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.1 mmm180 -79.85 -13.92 59.05 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 117.107 0.454 . . . . 999.99 111.332 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -97.3 114.33 26.08 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.714 -0.476 . . . . 999.99 109.714 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.2 pt -121.8 23.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.325 -0.398 . . . . 308.67 111.817 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -81.64 77.94 8.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 388.05 111.034 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 67.4 mtt -91.75 -2.65 56.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.059 -0.519 . . . . 360.57 110.817 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.31 -37.3 82.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.819 -0.628 . . . . 184.23 110.898 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -58.64 -44.94 90.23 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.472 -0.785 . . . . 999.99 111.205 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.67 -48.3 77.91 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.443 -0.344 . . . . 374.13 111.285 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -65.0 -39.84 94.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 999.99 111.051 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.34 -41.8 98.9 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.064 -0.516 . . . . 558.87 110.69 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.82 92.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.929 -0.578 . . . . 332.85 111.466 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.0 -42.07 99.75 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.43 -0.35 . . . . 472.21 110.862 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -63.72 -39.52 94.51 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 116.339 -0.392 . . . . 821.44 110.953 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.84 -39.8 82.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.063 -0.517 . . . . 746.24 111.545 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -84.56 -11.91 55.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.344 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.9 t30 54.38 42.96 31.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.953 -0.567 . . . . 675.44 111.524 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 63.3 tpp -127.87 118.64 24.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 999.99 111.107 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.0 mt -94.82 119.04 66.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 390.38 110.085 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.27 140.48 37.22 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.243 1.962 . . . . 243.11 112.83 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -85.88 150.39 24.56 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.063 -0.517 . . . . 618.1 110.846 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.617 ' HB2' HG13 ' A' ' 45' ' ' VAL . 50.5 t80 -67.61 125.27 25.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.784 0.326 . . . . 999.99 110.483 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.8 mt -98.96 145.61 30.26 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 415.25 111.336 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.86 -24.43 53.84 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.637 2.225 . . . . 529.15 111.97 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.85 -34.92 78.35 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.502 -0.772 . . . . 516.88 110.915 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.9 mtt -59.95 -39.5 85.78 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.091 -0.504 . . . . 914.6 110.483 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -61.44 -41.59 97.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.104 -0.498 . . . . 675.31 110.674 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -64.78 -42.18 95.28 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.074 -0.512 . . . . 900.95 110.828 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.8 mm -62.02 -46.65 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.088 -0.505 . . . . 300.73 111.07 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.5 -41.93 96.13 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.138 -0.483 . . . . 595.29 112.189 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -65.1 -35.81 82.31 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.448 0.536 . . . . 999.99 112.448 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.4 mtm -90.73 134.5 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.036 0.384 . . . . 385.68 112.036 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -53.09 146.13 21.41 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.668 -0.696 . . . . 999.99 111.755 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.24 -37.54 88.11 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.028 2.485 . . . . 149.6 112.949 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.77 -19.76 61.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.289 -0.414 . . . . 147.02 112.072 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -91.59 -21.67 20.71 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.185 0.439 . . . . 360.37 112.185 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.4 m -90.65 146.71 34.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.848 0.356 . . . . 187.93 111.306 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.53 156.73 53.75 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.702 2.268 . . . . 265.39 112.952 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.8 t -115.87 137.08 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.34 -0.615 . . . . 246.78 109.34 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -144.59 140.88 29.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.603 -0.271 . . . . 999.99 110.573 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -82.83 175.59 9.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.085 -0.507 . . . . 495.41 110.302 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.471 ' SD ' ' HA ' ' A' ' 60' ' ' THR . 27.9 ptm . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.3 -0.857 . . . . 761.34 110.961 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 111.831 0.308 . . . . 999.99 111.831 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.443 ' C ' ' H ' ' A' ' 4' ' ' HIS . 80.0 p -111.63 -13.34 13.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.651 0.262 . . . . 999.99 110.511 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.7 m0 68.54 -17.14 0.19 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.926 0.89 . . . . 999.99 112.658 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.443 ' H ' ' C ' ' A' ' 2' ' ' SER . 96.7 m-70 59.02 25.86 14.38 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.309 0.643 . . . . 999.99 112.138 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -145.65 -97.56 0.1 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.016 0.436 . . . . 999.99 110.885 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 71.3 t -119.68 125.36 74.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.007 -0.542 . . . . 375.52 110.354 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -82.46 147.44 56.25 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.477 -0.329 . . . . 999.99 110.901 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.71 152.41 47.66 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.73 2.287 . . . . 436.63 112.861 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -88.95 61.27 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.458 -0.337 . . . . 999.99 111.457 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 54.94 47.74 21.52 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.783 -0.644 . . . . 999.99 112.237 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.8 mt -56.68 142.27 40.68 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.322 -0.399 . . . . 781.6 111.064 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.37 114.06 19.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 216.75 111.102 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -64.12 -24.11 67.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.81 -0.632 . . . . 902.9 111.999 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.91 -39.16 84.48 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.885 0.374 . . . . 121.35 111.182 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -65.35 -34.88 79.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 265.05 109.965 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -64.15 -40.12 95.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.567 -0.742 . . . . 524.44 110.1 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.06 -46.87 95.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.774 -0.648 . . . . 214.56 111.186 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.04 -41.6 98.29 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.0 -0.546 . . . . 61.91 111.059 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 85' ' ' TYR . 62.4 tp -67.98 -41.03 82.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 321.59 111.428 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.98 -40.48 84.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.95 -0.568 . . . . 491.97 111.78 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.21 -43.78 98.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.726 0.298 . . . . 179.68 110.535 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.66 -39.12 91.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.393 . . . . 483.12 110.947 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.48 -42.37 95.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.153 -0.476 . . . . 120.91 110.603 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 91.9 mt -60.06 -41.14 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.693 -0.685 . . . . 324.41 111.642 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.51 -43.29 93.43 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.724 0.268 . . . . 76.38 111.724 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.44 -41.82 97.85 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.684 -0.77 . . . . 59.56 112.515 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -74.26 -18.29 60.75 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.963 0.357 . . . . 169.43 111.963 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.422 ' HA ' HD12 ' A' ' 31' ' ' LEU . 34.0 t70 -75.79 -31.49 59.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.401 -0.363 . . . . 145.09 110.908 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -62.8 -39.71 95.08 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.366 -0.605 . . . . 779.77 109.366 178.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.65 -35.78 91.69 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.376 -0.829 . . . . 72.33 112.409 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 54' ' ' ASN . 77.0 mt -61.88 -42.77 99.46 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.078 0.399 . . . . 213.67 112.078 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 33.5 m -74.23 -32.2 31.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 C-N-CA 120.651 -0.42 . . . . 275.82 111.298 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.09 -40.64 94.88 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.919 0.39 . . . . 545.0 110.576 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.522 ' HZ3' HD22 ' A' ' 42' ' ' LEU . 59.0 t90 -66.44 -39.5 88.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.031 -0.532 . . . . 999.99 109.582 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.13 -37.04 83.65 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.561 -0.745 . . . . 205.93 111.071 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.18 -36.66 84.36 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.644 0.259 . . . . 557.46 111.464 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.04 -51.62 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 113.599 0.963 . . . . 284.57 113.599 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -108.55 -4.67 17.01 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.274 0.842 . . . . 350.44 113.274 -177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.28 -12.23 72.28 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.125 -0.559 . . . . 199.7 113.95 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -61.18 -40.22 93.09 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.818 0.309 . . . . 999.99 111.339 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.8 p -112.36 8.7 19.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.517 -0.31 . . . . 302.8 111.796 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 ' HZ3' ' A' ' 34' ' ' TRP . 30.0 tp -71.46 131.69 43.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.373 -0.376 . . . . 581.97 111.32 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.0 t -70.54 152.34 44.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.136 -0.483 . . . . 239.07 110.732 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.7 m -59.88 -41.48 91.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.184 -0.462 . . . . 192.01 111.367 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 45' ' ' VAL . 2.1 t -68.76 -37.35 77.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.885 0.374 . . . . 278.45 110.464 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.43 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 97.5 mt-30 -64.13 -38.28 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.973 -0.558 . . . . 316.42 111.073 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.04 -45.11 93.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 470.35 110.682 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -63.47 -40.4 97.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.003 0.43 . . . . 369.78 110.408 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.07 91.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.705 -0.68 . . . . 66.79 111.338 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.95 -44.13 94.58 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.932 -0.576 . . . . 238.3 111.78 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -62.21 -40.25 95.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 526.93 110.288 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -62.72 -44.78 95.35 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.129 -0.487 . . . . 162.88 110.012 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 56.7 t -60.36 -40.43 83.96 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 CA-C-N 115.903 -0.589 . . . . 139.01 110.097 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB2' HD21 ' A' ' 31' ' ' LEU . 28.9 t-20 -58.93 -45.34 90.63 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.387 -0.37 . . . . 198.61 110.714 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -64.27 -42.46 96.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.762 0.315 . . . . 999.99 110.859 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -63.85 -44.71 92.35 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.234 0.54 . . . . 799.65 110.099 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -60.71 -46.95 88.43 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.249 -0.887 . . . . 151.58 110.936 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.9 ttp -59.45 -44.59 92.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.181 -0.463 . . . . 168.43 110.955 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -64.33 -42.23 96.39 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.882 0.372 . . . . 530.56 110.731 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.1 m -64.72 -44.89 88.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.886 -0.597 . . . . 293.49 110.772 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -63.96 -44.92 91.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.783 -0.644 . . . . 383.72 110.268 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -62.06 -45.1 95.05 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.65 -0.704 . . . . 497.0 111.713 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.45 79.66 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.396 0.517 . . . . 177.0 112.396 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -61.07 -48.54 81.27 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.643 0.259 . . . . 478.76 110.85 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -71.63 -39.02 70.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.413 . . . . 727.09 111.612 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 28.1 ttt -52.16 -46.27 65.41 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.551 0.575 . . . . 664.46 112.551 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.66 -42.14 96.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.713 -0.221 . . . . 447.74 111.331 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -68.67 -40.14 80.28 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.977 0.418 . . . . 999.99 110.492 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.3 -44.13 98.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 115.6 -0.727 . . . . 398.95 110.496 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.85 -41.49 91.56 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.06 -0.518 . . . . 366.97 111.2 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.99 -42.33 99.02 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.53 -0.305 . . . . 709.01 110.682 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.9 -41.59 91.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.148 -0.478 . . . . 931.14 110.808 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.541 HD13 ' HG3' ' A' ' 80' ' ' PRO . 95.0 mt -62.67 -46.23 96.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.911 -0.586 . . . . 175.26 110.663 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -61.59 -45.09 95.6 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.99 -0.55 . . . . 443.19 111.508 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.23 -41.01 99.05 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.47 -0.332 . . . . 366.44 111.764 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.94 -41.01 71.69 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.027 0.442 . . . . 386.93 111.345 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.33 -11.1 70.81 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.875 -0.602 . . . . 244.67 112.504 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.6 mpt_? -75.64 145.7 40.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.782 0.325 . . . . 999.99 111.432 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.0 t -91.6 116.53 66.63 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 121.009 0.433 . . . . 263.29 110.567 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.541 ' HG3' HD13 ' A' ' 73' ' ' ILE . 69.6 Cg_endo -72.66 145.12 40.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.617 2.212 . . . . 173.89 113.304 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 m -102.07 178.47 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 201.66 110.849 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.0 t -60.83 -42.53 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.241 -0.436 . . . . 81.09 110.517 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.28 -39.58 96.24 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 121.107 -0.568 . . . . 106.63 112.777 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.91 -40.58 95.95 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.023 0.439 . . . . 397.23 110.259 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD22 ' A' ' 19' ' ' LEU . 36.5 m-85 -67.44 -39.08 85.4 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.617 -0.719 . . . . 176.41 111.763 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.6 p -65.81 -34.81 79.03 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 111.9 0.333 . . . . 224.32 111.9 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -64.79 -41.54 95.76 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.005 0.431 . . . . 999.99 110.172 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -69.88 -40.5 75.65 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.698 -0.683 . . . . 158.17 110.623 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.8 -39.86 98.51 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.599 -0.728 . . . . 65.71 113.004 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.21 96.28 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.662 0.267 . . . . 95.38 111.135 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.67 -40.82 97.8 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.262 -0.426 . . . . 381.14 110.674 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.45 -42.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.811 -0.631 . . . . 182.12 110.865 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.95 -16.85 62.4 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.933 -0.576 . . . . 88.8 113.542 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -79.85 -13.82 59.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.864 0.332 . . . . 999.99 111.227 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -108.22 114.71 28.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 999.99 110.584 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.403 HG22 ' H ' ' A' ' 98' ' ' MET . 75.6 mt -125.52 118.59 52.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 308.67 110.471 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -106.02 19.27 20.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.544 -0.298 . . . . 388.05 111.789 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.41 ' O ' ' HB3' ' A' ' 101' ' ' PHE . 98.0 mtp -62.29 -38.3 88.83 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.04 0.385 . . . . 360.57 112.04 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.1 -39.59 90.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.096 0.474 . . . . 184.23 110.551 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.75 -24.48 59.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.666 -0.697 . . . . 999.99 111.269 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 98' ' ' MET . 86.8 t80 -58.16 -48.71 79.45 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.14 -0.482 . . . . 374.13 110.995 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.09 -39.46 94.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.393 -0.367 . . . . 999.99 111.005 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.92 -44.9 95.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.195 -0.457 . . . . 558.87 110.903 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.76 -41.23 99.13 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.104 -0.498 . . . . 332.85 111.319 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.99 -45.12 86.92 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.159 -0.473 . . . . 472.21 111.258 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -64.61 -39.82 94.41 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.482 -0.326 . . . . 821.44 111.269 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.06 -43.89 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.162 -0.472 . . . . 746.24 111.99 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -91.38 -3.76 56.4 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.412 -0.358 . . . . 999.99 111.317 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.4 t30 57.53 37.44 27.66 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.235 0.614 . . . . 675.44 111.139 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 38.6 mmt -105.8 83.57 1.94 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.982 -0.554 . . . . 999.99 110.675 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.51 116.67 66.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.458 -0.337 . . . . 390.38 110.789 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.37 157.68 45.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.728 2.285 . . . . 243.11 112.651 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -80.12 126.27 30.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.464 -0.335 . . . . 618.1 110.348 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 16.1 m-85 -70.03 90.96 0.66 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 999.99 111.33 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.7 145.31 29.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.485 -0.325 . . . . 415.25 110.477 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -79.51 45.3 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.493 2.129 . . . . 529.15 113.009 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -70.58 -29.22 65.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 516.88 110.393 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' MET . . . . . 0.4 ' HA ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttp -58.7 -43.31 90.02 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.608 -0.724 . . . . 914.6 111.113 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -61.11 -41.44 96.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.536 -0.302 . . . . 675.31 110.621 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.96 -41.22 82.78 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.011 -0.541 . . . . 900.95 111.911 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.4 HG22 ' HA ' ' A' ' 118' ' ' MET . 7.7 tp -73.52 -28.32 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 111.707 0.262 . . . . 300.73 111.707 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -70.21 -17.43 63.14 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.614 -0.266 . . . . 595.29 111.698 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -65.04 -33.13 75.3 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.467 -0.333 . . . . 999.99 111.614 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.4 mtm -95.47 134.63 38.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.643 -0.253 . . . . 385.68 111.174 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.0 mtt-85 -52.53 139.34 39.0 Favored Pre-proline 0 N--CA 1.465 0.281 0 CA-C-N 116.203 -0.453 . . . . 999.99 110.851 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -60.22 -26.09 81.71 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.869 2.379 . . . . 149.6 113.274 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.71 -36.8 81.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 147.02 111.647 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -92.19 -1.2 57.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.389 -0.368 . . . . 360.37 111.961 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.5 t -87.15 120.5 71.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.684 0.278 . . . . 187.93 110.711 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.83 158.4 55.65 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.512 2.142 . . . . 265.39 112.311 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 88.0 t -106.0 137.59 35.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.207 -0.452 . . . . 246.78 110.109 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -78.93 116.56 19.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.023 0.44 . . . . 999.99 110.951 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -84.18 153.28 23.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.83 -0.623 . . . . 495.41 110.623 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.154 -0.927 . . . . 761.34 110.908 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.585 ' HD3' HD22 ' A' ' 67' ' ' LEU . 44.0 ttm180 . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.698 0.285 . . . . 999.99 110.541 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 m -101.39 3.0 40.08 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.015 0.376 . . . . 999.99 112.015 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER 59.24 61.13 2.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.398 0.436 . . . . 999.99 111.726 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -82.22 -1.02 47.86 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.203 -0.453 . . . . 999.99 111.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -81.53 -160.86 0.37 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.257 -0.429 . . . . 999.99 110.922 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.3 m -99.98 142.31 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.02 0.438 . . . . 375.52 111.116 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.87 150.67 66.1 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.482 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.467 ' HA ' ' OD2' ' A' ' 74' ' ' ASP . 50.5 Cg_endo -68.38 138.2 41.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.268 1.979 . . . . 436.63 112.687 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -102.59 -9.3 20.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.009 -0.542 . . . . 999.99 110.639 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -107.22 9.14 30.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 999.99 111.104 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -57.13 125.92 24.87 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.987 -0.551 . . . . 781.6 111.104 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -108.53 113.94 27.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.507 -0.315 . . . . 216.75 110.38 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 58.3 mtmt -62.48 -39.18 92.64 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.101 -0.5 . . . . 902.9 111.782 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.72 85.8 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.936 0.398 . . . . 121.35 111.54 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -71.34 -29.31 64.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.24 -0.437 . . . . 265.05 110.72 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.416 ' OE1' ' HA ' ' A' ' 13' ' ' LYS . 54.3 mt-10 -64.62 -40.72 95.99 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.899 -0.592 . . . . 524.44 112.115 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 127' ' ' ALA . 27.8 m -68.7 -35.21 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 120.457 -0.497 . . . . 214.56 111.715 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.83 -41.55 95.98 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.002 0.43 . . . . 61.91 110.003 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.748 HD11 ' HA3' ' A' ' 89' ' ' GLY . 58.1 tp -68.82 -40.42 79.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.691 -0.686 . . . . 321.59 111.132 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -60.23 -38.01 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.04 -0.527 . . . . 491.97 111.881 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 69.0 t -63.04 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.622 0.249 . . . . 179.68 110.944 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.29 -41.52 89.68 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.644 0.259 . . . . 483.12 111.261 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.6 mt -70.09 -44.13 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.177 -0.465 . . . . 120.91 111.789 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.445 ' O ' ' HB2' ' A' ' 28' ' ' ASP . 6.3 tp -63.42 -33.9 64.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 CA-C-N 116.289 -0.414 . . . . 324.41 111.85 -178.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.57 -45.98 91.81 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.016 0.376 . . . . 76.38 112.016 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.28 -44.83 84.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.572 -0.823 . . . . 59.56 113.147 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -72.65 -18.66 61.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.194 0.442 . . . . 169.43 112.194 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 34.2 t70 -74.8 -39.48 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.1 -0.24 . . . . 145.09 111.561 -178.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -63.84 -41.34 97.84 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.616 -0.434 . . . . 779.77 110.174 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -41.02 99.84 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.831 -0.622 . . . . 72.33 112.078 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.7 tp -63.53 -44.42 94.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.682 0.277 . . . . 213.67 110.367 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.5 t -61.61 -44.6 98.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-N 116.11 -0.496 . . . . 275.82 110.813 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -62.24 -40.29 95.65 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.51 -0.314 . . . . 545.0 110.977 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.618 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 52.1 t90 -65.33 -42.01 93.38 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.398 -0.593 . . . . 999.99 109.398 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 86.6 mt -62.69 -35.49 79.88 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.271 -0.877 . . . . 205.93 111.296 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.94 -36.08 80.34 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.754 0.279 . . . . 557.46 111.754 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -86.31 -51.03 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 113.684 0.994 . . . . 284.57 113.684 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.619 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.2 m-70 -101.18 0.97 38.57 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.666 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -60.88 -36.48 92.11 Favored Glycine 0 N--CA 1.461 0.327 0 N-CA-C 114.095 0.398 . . . . 199.7 114.095 -179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -58.94 -39.42 81.57 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.818 0.303 . . . . 999.99 111.818 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -89.76 -10.19 46.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.861 0.689 . . . . 302.8 112.861 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.666 HD12 ' HA2' ' A' ' 39' ' ' GLY . 88.1 mt -73.0 138.38 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.89 0.376 . . . . 581.97 111.79 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.6 p -78.16 169.11 18.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 239.07 110.011 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.98 -42.27 98.05 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.751 0.31 . . . . 192.01 110.972 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.562 HG13 ' HB2' ' A' ' 114' ' ' TYR . 75.1 t -66.69 -43.26 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 116.232 -0.44 . . . . 278.45 111.145 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -63.19 -40.29 97.07 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.104 0.409 . . . . 316.42 112.104 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -61.09 -46.15 91.8 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.68 0.276 . . . . 470.35 111.061 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -70.67 -37.66 73.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.352 -0.385 . . . . 369.78 111.101 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.9 -36.77 80.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 66.79 111.888 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.55 -37.08 80.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.056 0.391 . . . . 238.3 112.056 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -61.56 -38.96 89.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.62 -0.511 . . . . 526.93 109.62 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -66.99 -39.32 87.13 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.742 -0.663 . . . . 162.88 109.481 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.16 -39.6 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.544 -0.753 . . . . 139.01 111.062 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -58.31 -42.33 86.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.436 -0.347 . . . . 198.61 110.731 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 94.9 mtm-85 -66.35 -39.35 89.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.152 -0.219 . . . . 999.99 110.46 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -63.51 -38.67 92.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.227 0.537 . . . . 799.65 109.751 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.72 -46.4 89.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.06 -0.973 . . . . 151.58 109.555 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 87.1 mtp -61.49 -42.99 99.63 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.768 -0.651 . . . . 168.43 110.865 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -62.72 -40.01 95.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.663 -0.699 . . . . 530.56 112.301 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -61.22 -49.32 77.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.734 0.302 . . . . 293.49 111.619 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -72.66 -39.31 67.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 383.72 111.92 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -64.58 -43.87 92.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 497.0 112.265 -178.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.64 -39.8 81.56 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.869 0.692 . . . . 177.0 112.869 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -60.8 -47.58 85.67 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.738 -0.21 . . . . 478.76 111.546 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.604 ' HB3' HD22 ' A' ' 88' ' ' LEU . 82.7 m-85 -71.28 -42.44 68.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.703 0.287 . . . . 727.09 111.77 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 96.9 mmm -56.39 -41.82 76.91 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 113.494 0.924 . . . . 664.46 113.494 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.585 HD22 ' HD3' ' A' ' 1' ' ' ARG . 65.2 tp -58.99 -46.62 87.69 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.189 0.44 . . . . 447.74 112.189 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -65.63 -42.45 91.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.863 0.363 . . . . 999.99 111.267 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.532 HG13 HD11 ' A' ' 88' ' ' LEU . 49.2 mm -72.0 -43.77 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 116.016 -0.538 . . . . 398.95 112.098 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.35 -38.77 88.18 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.942 0.349 . . . . 366.97 111.942 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -59.96 -45.94 91.01 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.697 -0.483 . . . . 709.01 109.697 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.89 -40.97 92.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.894 -0.594 . . . . 931.14 110.972 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 92.5 mt -62.26 -48.09 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.34 -0.391 . . . . 175.26 111.2 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.467 ' OD2' ' HA ' ' A' ' 8' ' ' PRO . 95.5 m-20 -63.39 -42.63 98.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 443.19 111.712 -179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.06 89.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 366.44 112.016 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -40.15 61.56 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.851 0.357 . . . . 386.93 111.55 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.28 -9.95 73.94 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.152 -0.547 . . . . 244.67 112.827 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -75.31 133.94 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.381 -0.229 . . . . 999.99 110.381 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.8 p -73.93 139.38 76.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.785 -0.189 . . . . 263.29 111.12 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.58 145.05 32.7 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.505 2.136 . . . . 173.89 113.203 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.7 m -102.68 170.23 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.936 -0.575 . . . . 201.66 110.854 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.92 -40.08 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.758 0.313 . . . . 81.09 110.461 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.1 -38.86 93.64 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.071 -0.513 . . . . 106.63 112.444 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.444 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.8 t70 -61.66 -42.71 99.28 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.96 -0.385 . . . . 397.23 109.96 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.512 ' HB3' HD22 ' A' ' 19' ' ' LEU . 56.9 m-85 -66.3 -40.45 89.99 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.755 -0.657 . . . . 176.41 111.27 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.7 p -66.12 -32.98 74.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.595 0.22 . . . . 224.32 111.595 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -61.73 -46.07 91.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.405 -0.591 . . . . 999.99 109.405 178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 65' ' ' TYR . 92.9 mt -66.75 -40.74 88.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.465 -0.789 . . . . 158.17 110.347 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.748 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.61 -39.57 98.05 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.439 -0.8 . . . . 65.71 113.685 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -60.54 -40.48 91.7 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.695 0.283 . . . . 95.38 110.988 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.61 -40.5 95.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.981 -0.554 . . . . 381.14 110.241 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.73 -43.43 96.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.56 -0.746 . . . . 182.12 111.146 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.24 -13.92 63.18 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-N 115.824 -0.625 . . . . 88.8 114.001 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -79.38 -15.66 57.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.305 0.552 . . . . 999.99 111.479 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -108.66 111.81 23.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 999.99 110.93 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 77.4 mt -124.47 120.35 58.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.809 -0.441 . . . . 308.67 109.809 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -152.6 55.21 0.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 388.05 111.2 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.4 mmm -64.48 -38.83 92.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.009 -0.542 . . . . 360.57 111.704 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.38 89.37 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 184.23 111.675 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -60.02 -47.52 85.51 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.918 -0.583 . . . . 999.99 111.637 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -57.75 -45.73 85.49 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.122 0.264 . . . . 374.13 111.062 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.56 -48.13 82.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.569 0.223 . . . . 999.99 110.546 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.94 -41.69 99.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.417 -0.356 . . . . 558.87 110.98 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.48 94.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.101 -0.5 . . . . 332.85 111.055 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 110' ' ' MET . 59.6 tp -61.07 -43.79 98.35 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.652 -0.703 . . . . 472.21 110.587 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -62.96 -39.84 95.87 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.189 -0.46 . . . . 821.44 110.557 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.38 -40.36 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.741 -0.663 . . . . 746.24 111.503 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -82.74 -11.52 58.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.324 -0.398 . . . . 999.99 111.507 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.9 t30 54.89 44.91 27.59 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.527 0.517 . . . . 675.44 111.576 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' MET . . . . . 0.417 ' O ' HD11 ' A' ' 105' ' ' LEU . 66.9 mtt -115.39 83.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 999.99 110.878 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.8 mm -93.42 116.81 67.02 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.657 0.265 . . . . 390.38 110.642 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.54 150.31 45.56 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.718 2.279 . . . . 243.11 112.754 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -84.25 142.18 30.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 618.1 110.225 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.562 ' HB2' HG13 ' A' ' 45' ' ' VAL . 67.3 t80 -68.13 113.77 6.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 999.99 110.653 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -99.31 148.63 34.92 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.099 -0.5 . . . . 415.25 111.364 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.93 -19.2 58.33 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.841 2.361 . . . . 529.15 111.873 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -61.53 -35.88 78.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.743 . . . . 516.88 110.855 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 17.8 tpt -58.41 -42.23 86.72 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.081 -0.508 . . . . 914.6 110.574 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.17 -40.4 93.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.16 -0.473 . . . . 675.31 110.429 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -63.66 -42.31 98.1 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.115 -0.493 . . . . 900.95 111.031 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 32.0 mm -61.67 -45.14 99.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 116.433 -0.349 . . . . 300.73 110.807 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.968 -0.56 . . . . 595.29 111.524 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -67.6 -33.66 75.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.293 0.479 . . . . 999.99 112.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -80.3 137.36 36.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 385.68 112.034 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.481 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.2 mtt-85 -53.5 144.04 34.28 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.413 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.46 -33.77 68.89 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.116 2.544 . . . . 149.6 112.86 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -60.75 -35.94 77.66 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.066 -0.515 . . . . 147.02 111.809 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -91.27 0.97 57.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.41 -0.359 . . . . 360.37 111.944 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 125' ' ' ARG . 57.5 t -96.0 111.15 55.25 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.779 0.323 . . . . 187.93 110.811 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -77.04 163.05 31.29 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.782 2.321 . . . . 265.39 112.969 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.4 m -120.9 153.92 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.053 -0.521 . . . . 246.78 109.857 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -116.75 124.06 48.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.041 0.448 . . . . 999.99 111.352 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -83.2 148.95 27.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 495.41 109.825 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.032 -0.985 . . . . 761.34 110.945 -179.503 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.405 ' NH1' ' H ' ' A' ' 132' ' ' LYS . 47.1 mtm180 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 120.51 0.195 . . . . 999.99 110.496 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -152.08 146.77 25.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.596 -0.274 . . . . 999.99 110.466 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 54.0 m0 -110.27 130.78 55.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.93 -0.396 . . . . 999.99 109.93 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.1 m170 -111.46 17.71 19.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.552 -0.295 . . . . 999.99 111.583 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -107.27 -99.46 0.36 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.687 0.28 . . . . 999.99 110.949 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.498 HG21 ' HG2' ' A' ' 71' ' ' LYS . 61.4 t -119.34 122.13 68.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.22 -0.289 . . . . 375.52 110.22 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 96.6 mt-10 -90.72 121.94 67.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.494 -0.321 . . . . 999.99 110.982 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 48.6 Cg_exo -59.91 146.86 94.79 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.7 2.267 . . . . 436.63 112.06 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -61.64 -40.29 94.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.331 -0.395 . . . . 999.99 111.777 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -148.81 90.2 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.179 -0.208 . . . . 999.99 111.084 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 56.9 tp -58.98 122.91 14.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.276 -0.42 . . . . 781.6 110.381 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -101.43 102.65 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.921 0.391 . . . . 216.75 110.61 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -65.06 -38.51 91.04 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.799 -0.637 . . . . 902.9 112.052 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.71 84.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.043 0.386 . . . . 121.35 112.043 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.018 -0.364 . . . . 265.05 110.018 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -63.89 -40.58 96.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.875 -0.602 . . . . 524.44 110.456 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -62.18 -47.32 93.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.963 -0.562 . . . . 214.56 111.19 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.94 98.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 61.91 111.453 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 85' ' ' TYR . 85.3 mt -69.06 -39.01 79.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.273 0.471 . . . . 321.59 112.273 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.561 ' HE3' HG21 ' A' ' 131' ' ' VAL . 6.3 mttm -57.56 -42.85 83.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.861 1.06 . . . . 491.97 113.861 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.29 -37.23 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.211 -0.595 . . . . 179.68 111.232 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -70.89 -39.89 72.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 483.12 110.718 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.419 HG21 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -63.58 -43.64 98.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.672 -0.694 . . . . 120.91 111.177 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -59.64 -42.83 89.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.008 -0.542 . . . . 324.41 111.409 -178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.51 96.7 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.042 -0.263 . . . . 76.38 111.385 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.26 -42.87 93.92 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 120.898 -0.668 . . . . 59.56 112.938 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -73.37 -20.15 60.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.959 0.355 . . . . 169.43 111.959 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -77.17 -33.89 56.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.662 -0.245 . . . . 145.09 110.732 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -61.55 -42.71 99.23 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 109.807 -0.442 . . . . 779.77 109.807 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.19 -38.67 82.82 Favored Glycine 0 CA--C 1.519 0.293 0 CA-C-N 115.846 -0.615 . . . . 72.33 112.141 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.9 tp -62.87 -44.64 95.58 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.238 0.458 . . . . 213.67 112.238 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.62 -31.79 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 120.799 -0.36 . . . . 275.82 111.588 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -40.79 97.31 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.918 0.39 . . . . 545.0 109.964 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -64.03 -43.85 94.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.599 -0.728 . . . . 999.99 109.904 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.76 -37.58 84.81 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.176 -0.92 . . . . 205.93 111.575 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -68.31 -20.28 64.74 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.983 0.364 . . . . 557.46 111.983 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.1 t -84.09 -41.45 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.914 0.388 . . . . 284.57 111.136 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -103.92 19.08 20.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.884 0.373 . . . . 350.44 110.895 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.51 -35.88 82.13 Favored Glycine 0 N--CA 1.459 0.228 0 CA-C-N 115.529 -0.76 . . . . 199.7 114.122 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -59.74 -39.59 85.25 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.936 0.346 . . . . 999.99 111.936 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.2 p -110.24 12.22 23.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.66 0.615 . . . . 302.8 112.66 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.474 ' HA ' HD22 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.35 123.69 22.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 581.97 111.663 -179.328 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.462 ' HB2' ' HB2' ' A' ' 46' ' ' GLN . 70.7 m -78.67 154.66 29.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.092 -0.504 . . . . 239.07 110.491 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -61.1 -46.45 90.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.862 0.319 . . . . 192.01 111.862 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.5 t -73.01 -30.23 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 121.114 0.483 . . . . 278.45 110.452 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.462 ' HB2' ' HB2' ' A' ' 43' ' ' SER . 64.6 tt0 -60.62 -38.98 86.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.462 -0.79 . . . . 316.42 111.27 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -59.29 -46.32 88.87 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 110.342 -0.244 . . . . 470.35 110.342 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.43 -39.4 92.06 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.987 0.422 . . . . 369.78 110.595 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.4 87.82 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.741 -0.663 . . . . 66.79 111.818 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.42 -37.01 72.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.269 -0.423 . . . . 238.3 111.975 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -63.75 -40.75 97.46 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.736 0.303 . . . . 526.93 110.217 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.96 -43.55 92.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.968 -0.56 . . . . 162.88 109.94 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 68.6 t -61.19 -41.03 87.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.487 -0.779 . . . . 139.01 110.077 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -59.7 -42.72 93.64 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.91 -0.586 . . . . 198.61 110.272 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.404 ' NH1' ' HA ' ' A' ' 122' ' ' ASN . 99.2 mtt180 -63.71 -41.61 98.06 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.702 -0.227 . . . . 999.99 110.91 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -62.13 -45.54 93.02 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.024 0.44 . . . . 799.65 110.064 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -60.4 -45.92 91.83 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.602 -0.726 . . . . 151.58 110.156 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.419 ' SD ' HG21 ' A' ' 23' ' ' ILE . 30.3 ttp -58.81 -42.92 90.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.304 -0.862 . . . . 168.43 110.821 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.33 -42.35 98.97 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.276 -0.42 . . . . 530.56 111.832 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.3 p -71.55 -39.09 70.89 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 111.69 0.255 . . . . 293.49 111.69 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -64.25 -45.83 86.42 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.139 0.495 . . . . 383.72 110.406 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.78 -39.65 91.2 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.691 -0.686 . . . . 497.0 112.538 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -43.19 89.64 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.084 0.402 . . . . 177.0 112.084 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.03 -47.41 83.18 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.858 0.361 . . . . 478.76 111.108 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.428 ' HE2' HD23 ' A' ' 88' ' ' LEU . 62.1 t80 -68.38 -44.34 75.38 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.053 -0.521 . . . . 727.09 111.326 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.2 ttp -53.56 -46.03 70.09 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.752 -0.658 . . . . 664.46 112.195 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.9 mt -61.54 -39.88 92.65 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.716 0.265 . . . . 447.74 111.716 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -62.07 -47.79 83.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.448 -0.342 . . . . 999.99 111.656 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 pt -80.42 -28.09 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.671 0.619 . . . . 398.95 112.671 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -61.45 -40.2 93.65 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.526 0.203 . . . . 366.97 111.433 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.498 ' HG2' HG21 ' A' ' 6' ' ' VAL . 98.2 mttt -61.76 -42.18 98.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.488 -0.324 . . . . 709.01 110.592 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -67.96 -42.14 81.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 931.14 111.044 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.86 -46.91 92.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.291 -0.413 . . . . 175.26 111.063 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -63.37 -43.86 96.45 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.211 -0.449 . . . . 443.19 111.471 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.98 95.93 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.214 -0.448 . . . . 366.44 111.823 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.35 -40.68 67.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.473 -0.33 . . . . 386.93 111.173 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -8.17 79.55 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.89 -0.672 . . . . 244.67 112.706 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.0 mtp180 -74.23 142.83 45.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.787 0.327 . . . . 999.99 110.864 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.2 p -103.21 113.07 66.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.487 -0.324 . . . . 263.29 111.146 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.61 151.64 58.62 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.596 2.197 . . . . 173.89 112.829 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -100.68 178.52 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.938 -0.574 . . . . 201.66 111.512 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 86' ' ' THR . 68.5 t -59.71 -43.41 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.868 -0.606 . . . . 81.09 110.937 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.27 -40.84 97.93 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.789 -0.72 . . . . 106.63 112.463 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.001 0.429 . . . . 397.23 110.154 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.555 ' HB3' HD21 ' A' ' 19' ' ' LEU . 22.5 m-85 -64.75 -39.08 93.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.618 -0.719 . . . . 176.41 112.044 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 82' ' ' VAL . 75.9 p -65.87 -33.13 75.12 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.829 0.307 . . . . 224.32 111.829 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -61.94 -47.09 86.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.089 0.471 . . . . 999.99 109.969 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.428 HD23 ' HE2' ' A' ' 65' ' ' TYR . 10.9 mp -70.12 -40.25 74.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.728 -0.669 . . . . 158.17 110.575 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.68 -39.75 97.84 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.74 -0.664 . . . . 65.71 112.81 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.14 93.13 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.738 0.304 . . . . 95.38 110.887 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.23 -40.84 94.59 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.129 -0.487 . . . . 381.14 110.173 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.96 -43.11 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.818 . . . . 182.12 111.183 179.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.59 -24.88 66.57 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 116.156 -0.475 . . . . 88.8 113.578 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -81.18 -12.67 59.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 0.329 . . . . 999.99 111.804 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.4 mmt180 -108.38 112.43 24.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.97 0.414 . . . . 999.99 111.366 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 pt -134.32 153.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 308.67 110.623 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -152.93 43.23 0.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.048 0.452 . . . . 388.05 110.664 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.7 mtp -65.23 -36.55 84.51 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.811 -0.631 . . . . 360.57 111.737 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.13 84.14 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.061 -0.518 . . . . 184.23 111.609 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -60.04 -48.41 81.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.551 -0.295 . . . . 999.99 110.694 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -43.53 98.55 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.274 -0.421 . . . . 374.13 110.338 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -47.83 84.25 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.985 -0.552 . . . . 999.99 110.807 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.36 -40.31 93.83 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.252 -0.431 . . . . 558.87 110.899 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.03 99.85 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.409 -0.359 . . . . 332.85 110.924 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.34 -40.81 94.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.048 -0.524 . . . . 472.21 110.663 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.97 -42.6 99.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.816 -0.629 . . . . 821.44 111.13 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.66 -42.39 83.44 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.97 -0.559 . . . . 746.24 111.744 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.0 1.77 56.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.524 -0.307 . . . . 999.99 111.352 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 57.96 41.65 24.1 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.237 0.615 . . . . 675.44 111.925 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.95 81.63 2.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.935 0.397 . . . . 999.99 110.513 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.2 mt -93.84 118.61 67.36 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.503 . . . . 390.38 110.401 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.82 149.11 53.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.598 2.199 . . . . 243.11 112.717 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.71 135.92 33.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.242 -0.436 . . . . 618.1 110.436 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.73 109.36 3.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.357 . . . . 999.99 111.014 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 89.0 mt -97.23 125.08 46.98 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 415.25 111.237 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 77.2 Cg_exo -55.47 -31.96 80.33 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.277 2.651 . . . . 529.15 113.051 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -62.12 -36.52 81.99 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.371 -0.377 . . . . 516.88 111.091 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 61.1 mtt -60.31 -38.73 84.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.449 -0.341 . . . . 914.6 110.319 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.11 -39.44 89.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.932 -0.576 . . . . 675.31 110.291 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 124' ' ' MET . 97.9 mt-10 -64.03 -40.15 95.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.999 -0.546 . . . . 900.95 110.909 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.6 mt -61.42 -41.79 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.022 0.439 . . . . 300.73 110.45 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASN . . . . . 0.404 ' HA ' ' NH1' ' A' ' 55' ' ' ARG . 99.4 m-20 -60.33 -37.34 80.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 595.29 110.89 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -74.74 -10.85 59.91 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.077 -0.511 . . . . 999.99 112.335 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 65.4 mtt -77.38 119.91 21.66 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.982 -0.287 . . . . 385.68 110.786 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -52.98 120.72 20.34 Favored Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 116.015 -0.538 . . . . 999.99 112.012 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -58.92 -35.83 97.93 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.884 2.39 . . . . 149.6 112.827 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.32 -37.07 85.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.695 0.628 . . . . 147.02 112.695 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -90.84 -22.07 21.16 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.432 0.53 . . . . 360.37 112.432 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 124' ' ' MET . 62.0 t -105.34 109.02 62.73 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 121.028 -0.269 . . . . 187.93 110.774 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.85 138.98 85.99 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.476 2.117 . . . . 265.39 112.463 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.561 HG21 ' HE3' ' A' ' 20' ' ' LYS . 96.6 t -128.54 137.7 56.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.127 -0.488 . . . . 246.78 111.31 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.405 ' H ' ' NH1' ' A' ' 1' ' ' ARG . 58.9 mtmt -122.9 147.72 46.27 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.218 -0.66 . . . . 999.99 109.218 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -83.52 125.72 32.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.727 0.298 . . . . 495.41 110.99 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.4 mtm . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.4 -0.81 . . . . 761.34 111.311 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.883 0.373 . . . . 999.99 110.74 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 m -103.43 97.25 7.33 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.837 -0.801 . . . . 999.99 108.837 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.419 ' HB2' ' O ' ' A' ' 134' ' ' MET . 34.7 p-90 -98.72 1.72 46.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.216 -0.447 . . . . 999.99 111.892 -178.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -149.73 148.89 29.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.702 -0.227 . . . . 999.99 110.461 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -65.62 -36.75 84.62 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.124 -0.489 . . . . 999.99 111.4 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.34 130.25 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.205 -0.452 . . . . 375.52 109.913 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -80.94 119.31 75.68 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.281 -0.418 . . . . 999.99 111.046 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -59.69 144.9 99.34 Favored 'Trans proline' 0 C--N 1.35 0.605 0 C-N-CA 122.973 2.449 . . . . 436.63 111.854 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -120.35 151.42 39.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.822 0.344 . . . . 999.99 111.733 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 63.36 29.17 15.7 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.291 -0.868 . . . . 999.99 112.605 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -57.99 128.22 36.02 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.641 0.258 . . . . 781.6 111.078 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -114.07 114.74 26.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.594 -0.276 . . . . 216.75 110.414 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.76 -39.39 94.0 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.252 -0.431 . . . . 902.9 111.635 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.91 87.6 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.409 -0.359 . . . . 121.35 111.642 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -68.37 -31.37 70.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 265.05 110.398 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.76 -39.91 95.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.909 -0.587 . . . . 524.44 110.679 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.8 t -62.13 -46.81 95.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.013 0.435 . . . . 214.56 110.86 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.57 93.99 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.626 -0.715 . . . . 61.91 110.596 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 85' ' ' TYR . 65.1 tp -64.27 -45.28 88.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.602 -0.726 . . . . 321.59 111.883 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -61.77 -40.75 96.27 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.259 0.837 . . . . 491.97 113.259 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.65 -33.76 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.221 -0.591 . . . . 179.68 111.485 -179.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.05 -40.67 78.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.047 0.451 . . . . 483.12 109.898 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.15 -43.29 95.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 115.442 -0.799 . . . . 120.91 110.64 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -60.88 -43.27 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.839 -0.619 . . . . 324.41 111.276 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -43.32 98.49 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.618 0.229 . . . . 76.38 111.618 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.24 -42.28 97.95 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.881 -0.676 . . . . 59.56 112.733 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -74.7 -18.29 60.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.8 0.333 . . . . 169.43 111.505 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -75.73 -31.79 59.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.344 -0.389 . . . . 145.09 110.912 -178.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -60.76 -46.08 91.83 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.465 -0.569 . . . . 779.77 109.465 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.98 93.56 Favored Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.605 -0.725 . . . . 72.33 111.751 178.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.87 -48.27 82.59 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.428 -0.386 . . . . 213.67 111.655 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.89 -29.45 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 C-N-CA 120.929 -0.308 . . . . 275.82 111.214 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.528 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 64.2 tttm -62.41 -43.78 98.0 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.967 0.413 . . . . 545.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.792 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 27.5 t90 -70.22 -39.51 75.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.16 -0.473 . . . . 999.99 110.18 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.29 -38.42 91.09 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.619 0.6 . . . . 205.93 112.619 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -66.32 -19.17 65.74 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.885 -0.509 . . . . 557.46 111.431 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.11 -52.56 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 112.551 0.575 . . . . 284.57 112.551 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -111.6 -8.08 14.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.951 0.723 . . . . 350.44 112.951 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.64 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -67.82 -17.82 69.76 Favored Glycine 0 N--CA 1.46 0.241 0 C-N-CA 121.252 -0.499 . . . . 199.7 113.567 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -61.18 -39.37 89.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.752 0.31 . . . . 999.99 111.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -91.6 -8.22 47.92 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.688 0.625 . . . . 302.8 112.688 -179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.792 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 96.1 mt -72.8 141.86 48.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.884 0.373 . . . . 581.97 111.509 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.9 p -77.59 168.44 19.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.068 -0.514 . . . . 239.07 110.375 178.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 87.0 m -60.9 -40.44 93.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.881 0.372 . . . . 192.01 110.713 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.679 HG13 ' HB2' ' A' ' 114' ' ' TYR . 61.8 t -65.6 -44.28 93.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.004 -0.543 . . . . 278.45 110.946 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -63.99 -41.57 97.47 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.422 -0.354 . . . . 316.42 111.232 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -62.89 -46.32 88.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.458 -0.337 . . . . 470.35 110.825 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -65.09 -40.72 94.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.118 -0.492 . . . . 369.78 110.909 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.19 78.95 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.859 -0.61 . . . . 66.79 111.499 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.01 -39.18 81.09 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.043 -0.526 . . . . 238.3 111.327 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -60.77 -40.17 91.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.701 0.286 . . . . 526.93 110.527 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.506 ' HB2' ' SD ' ' A' ' 118' ' ' MET . 61.4 t80 -66.39 -39.75 89.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.219 -0.446 . . . . 162.88 109.887 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.7 t -60.99 -43.86 96.95 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.712 -0.676 . . . . 139.01 110.025 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.68 -40.4 91.99 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.903 -0.59 . . . . 198.61 109.98 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' MET . 77.4 ttt-85 -60.35 -47.91 84.01 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.808 -0.633 . . . . 999.99 110.757 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.4 mmm-85 -64.59 -40.77 96.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.098 0.475 . . . . 799.65 110.793 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -62.51 -48.16 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.663 -0.698 . . . . 151.58 112.48 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.499 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 4.9 ppp? -64.36 -38.37 90.79 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.172 0.804 . . . . 168.43 113.172 -178.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.41 -39.14 71.3 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.482 -0.487 . . . . 530.56 111.78 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.6 p -73.82 -41.33 62.47 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 111.72 0.267 . . . . 293.49 111.72 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -63.76 -45.87 87.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.834 0.35 . . . . 383.72 110.427 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.456 ' CZ2' HD21 ' A' ' 19' ' ' LEU . 74.9 t-105 -62.38 -47.56 83.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.896 -0.593 . . . . 497.0 111.729 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.73 88.33 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.502 -0.317 . . . . 177.0 111.709 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -61.41 -46.87 88.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.838 0.351 . . . . 478.76 110.709 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.51 -46.7 84.85 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 727.09 110.865 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.5 mmm -52.04 -19.66 2.0 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.183 1.179 . . . . 664.46 114.183 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.0 mt -59.77 -43.59 94.27 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 118.257 0.481 . . . . 447.74 110.587 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -68.43 -45.54 72.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.03 -0.532 . . . . 999.99 111.271 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.0 mm -67.95 -41.11 84.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 115.465 -0.789 . . . . 398.95 112.787 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -59.2 -39.15 81.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.052 0.39 . . . . 366.97 112.052 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.83 -42.28 97.42 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 121.042 -0.263 . . . . 709.01 110.955 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.29 -42.06 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.528 -0.306 . . . . 931.14 111.64 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.67 -47.99 88.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.53 -0.305 . . . . 175.26 111.291 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.31 -40.32 97.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.219 -0.446 . . . . 443.19 111.504 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.31 -40.74 96.54 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.495 -0.32 . . . . 366.44 111.51 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.26 -40.28 77.92 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.817 0.341 . . . . 386.93 111.279 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.05 -8.48 79.75 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.978 -0.63 . . . . 244.67 112.776 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.6 mmt180 -74.57 145.63 43.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.61 0.243 . . . . 999.99 111.063 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 79.8 p -72.14 138.12 81.77 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.436 -0.347 . . . . 263.29 110.845 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 36.1 Cg_exo -61.51 135.36 56.62 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.537 2.158 . . . . 173.89 112.842 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.632 HG13 ' H ' ' A' ' 84' ' ' ASP . 12.2 p -104.07 150.58 7.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.467 -0.333 . . . . 201.66 110.235 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.93 -42.07 95.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 111.974 0.361 . . . . 81.09 111.974 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.23 -43.13 97.42 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 120.906 -0.664 . . . . 106.63 113.546 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.632 ' H ' HG13 ' A' ' 81' ' ' VAL . 36.9 t70 -63.89 -43.02 97.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.03 0.443 . . . . 397.23 110.435 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD13 ' A' ' 19' ' ' LEU . 3.9 m-30 -64.42 -41.12 96.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.545 -0.752 . . . . 176.41 111.774 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.5 p -67.91 -36.19 79.76 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 121.011 -0.276 . . . . 224.32 111.306 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -62.61 -45.99 90.34 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.223 0.535 . . . . 999.99 109.639 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.72 -39.8 91.54 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.42 -0.809 . . . . 158.17 110.53 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.67 -39.71 97.78 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.633 -0.712 . . . . 65.71 112.771 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.71 94.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.651 0.262 . . . . 95.38 110.971 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -65.54 -40.65 93.12 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.144 0.497 . . . . 381.14 110.522 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.2 mm -65.52 -41.79 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.461 -0.791 . . . . 182.12 111.21 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.41 -16.96 61.32 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.899 -0.592 . . . . 88.8 113.707 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -79.78 -13.92 59.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 117.034 0.417 . . . . 999.99 111.362 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -108.58 119.81 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.772 0.32 . . . . 999.99 110.433 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.2 pt -129.82 156.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 308.67 111.483 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -136.21 21.62 3.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.344 0.592 . . . . 388.05 109.974 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.5 mtp -64.54 -39.48 93.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.324 -0.853 . . . . 360.57 112.23 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.98 -40.88 97.11 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.246 0.461 . . . . 184.23 112.246 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -78.5 -21.6 48.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.594 -0.275 . . . . 999.99 111.687 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.481 ' CE2' HD11 ' A' ' 105' ' ' LEU . 88.3 t80 -59.46 -46.76 87.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.474 -0.33 . . . . 374.13 111.013 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -62.0 -39.44 92.24 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.697 0.284 . . . . 999.99 110.902 179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -62.59 -42.72 99.73 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.112 -0.495 . . . . 558.87 110.23 179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.23 -40.24 95.47 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.802 -0.635 . . . . 332.85 111.092 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.55 -42.12 99.34 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.355 -0.384 . . . . 472.21 110.835 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.66 -44.0 97.37 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.279 -0.419 . . . . 821.44 110.976 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.89 -39.92 82.85 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.032 -0.531 . . . . 746.24 111.935 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.17 -2.23 56.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.45 -0.341 . . . . 999.99 111.527 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.2 t30 56.66 43.71 24.99 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 123.64 0.588 . . . . 675.44 111.299 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 78.9 mtm -103.85 111.16 23.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.368 . . . . 999.99 111.371 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 72.3 mt -94.67 118.92 66.79 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 390.38 109.996 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.83 118.88 5.77 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.159 1.906 . . . . 243.11 112.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.75 142.88 28.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 618.1 110.623 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.679 ' HB2' HG13 ' A' ' 45' ' ' VAL . 86.9 t80 -67.36 125.78 27.18 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.721 0.296 . . . . 999.99 110.906 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.2 mt -99.53 144.7 28.78 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.269 -0.423 . . . . 415.25 110.87 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.25 -18.89 50.72 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.667 2.245 . . . . 529.15 112.056 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -62.61 -26.67 68.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.475 -0.784 . . . . 516.88 111.358 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 52' ' ' PHE . 93.9 mmm -59.88 -38.92 83.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.256 -0.429 . . . . 914.6 111.529 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.88 -40.87 94.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.573 -0.285 . . . . 675.31 110.73 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -65.35 -40.98 94.3 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.429 -0.35 . . . . 900.95 111.181 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 28.6 mm -61.91 -45.02 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.384 -0.371 . . . . 300.73 111.08 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.12 -39.69 95.43 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.024 0.379 . . . . 595.29 112.024 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -70.19 -33.18 71.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.7 mtm -88.06 132.93 34.1 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.535 0.569 . . . . 385.68 112.535 -178.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.9 mmt180 -53.77 145.54 30.68 Favored Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.586 -0.734 . . . . 999.99 110.874 178.093 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.61 -30.06 90.97 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.671 2.247 . . . . 149.6 112.884 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.73 -36.03 81.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.233 -0.439 . . . . 147.02 111.234 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -91.98 0.48 57.47 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.552 0.575 . . . . 360.37 112.552 -178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 66.3 t -83.13 116.6 65.15 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 187.93 110.964 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.56 156.34 49.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.821 2.348 . . . . 265.39 112.696 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 m -129.61 159.93 41.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.13 -0.486 . . . . 246.78 110.564 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -118.12 136.04 53.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.976 0.417 . . . . 999.99 111.521 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.3 165.64 18.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 495.41 110.349 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.419 ' O ' ' HB2' ' A' ' 3' ' ' TRP . 3.4 mtt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.158 -0.925 . . . . 761.34 111.082 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 120.773 0.32 . . . . 999.99 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.8 m -110.18 108.89 19.2 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.169 -0.678 . . . . 999.99 109.169 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 -113.32 -141.55 0.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.559 -0.292 . . . . 999.99 110.803 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.4 m170 68.02 -118.8 0.19 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.408 0.442 . . . . 999.99 110.568 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 63.27 -92.16 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.867 0.467 . . . . 999.99 111.632 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.0 t -119.72 127.55 75.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.815 0.341 . . . . 375.52 110.809 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -90.2 120.39 69.17 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 999.99 110.341 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.28 147.73 53.85 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.661 2.241 . . . . 436.63 112.906 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -157.16 -25.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.047 -0.524 . . . . 999.99 111.579 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -87.19 -12.63 46.3 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.288 0.477 . . . . 999.99 112.288 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.63 139.25 54.09 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.099 0.476 . . . . 781.6 112.036 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -100.52 123.57 44.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.771 -0.65 . . . . 216.75 110.008 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.45 -38.82 88.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.466 . . . . 902.9 111.282 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.77 86.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.404 -0.362 . . . . 121.35 111.562 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -68.51 -32.7 72.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 265.05 110.061 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -64.47 -38.62 91.65 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.8 -0.637 . . . . 524.44 110.018 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.71 -45.12 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 115.663 -0.699 . . . . 214.56 110.724 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.11 94.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 61.91 110.68 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.564 HD21 ' HB3' ' A' ' 85' ' ' TYR . 84.8 mt -65.81 -38.59 89.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.899 -0.591 . . . . 321.59 111.566 178.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -60.61 -38.19 83.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.207 -0.452 . . . . 491.97 111.695 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.95 -43.6 99.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 179.68 110.43 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.76 -41.48 97.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.208 -0.451 . . . . 483.12 110.767 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.41 -43.54 97.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.876 -0.602 . . . . 120.91 110.88 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.32 -40.81 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.726 -0.67 . . . . 324.41 111.64 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.85 -43.32 94.69 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.631 0.234 . . . . 76.38 111.631 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.41 -42.62 97.56 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.677 -0.773 . . . . 59.56 112.537 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -72.41 -19.91 61.52 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 111.97 0.359 . . . . 169.43 111.97 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -31.96 58.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.612 -0.267 . . . . 145.09 111.263 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 41.0 mmt180 -61.57 -42.48 98.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.894 0.378 . . . . 779.77 110.176 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.17 70.18 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.992 -0.549 . . . . 72.33 112.195 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -60.71 -46.27 91.03 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.341 0.497 . . . . 213.67 112.341 -178.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.1 m -68.72 -26.68 33.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 112.37 0.507 . . . . 275.82 112.37 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 48.5 mmtm -63.6 -43.12 97.84 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.711 0.291 . . . . 545.0 111.072 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.453 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 86.2 m95 -81.14 -28.06 35.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.732 0.301 . . . . 999.99 111.128 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.84 -43.87 97.7 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.851 -0.613 . . . . 205.93 111.537 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -70.89 -20.87 62.46 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.822 0.304 . . . . 557.46 111.822 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.8 t -87.59 -49.75 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.498 0.555 . . . . 284.57 112.498 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.47 8.75 41.93 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.449 0.537 . . . . 350.44 112.449 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.86 -38.9 96.08 Favored Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.333 -0.461 . . . . 199.7 113.719 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.7 ptm180 -64.43 -23.65 67.36 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.493 0.553 . . . . 999.99 112.493 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.529 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.5 p -112.36 1.99 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.085 0.402 . . . . 302.8 112.085 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.0 tp -72.52 124.4 25.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.348 . . . . 581.97 111.21 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.6 m -77.93 156.36 30.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 239.07 110.858 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.4 m -61.08 -42.84 99.24 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.376 -0.375 . . . . 192.01 111.013 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.592 HG13 ' HB2' ' A' ' 114' ' ' TYR . 66.7 t -66.09 -42.07 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 116.166 -0.47 . . . . 278.45 110.597 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -62.98 -40.52 97.98 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.066 -0.516 . . . . 316.42 111.222 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.76 -47.71 85.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.43 -0.35 . . . . 470.35 110.995 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.24 -40.8 90.48 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.879 0.371 . . . . 369.78 110.953 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.63 93.91 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.796 -0.638 . . . . 66.79 111.881 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.3 -39.54 83.34 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.225 -0.443 . . . . 238.3 112.12 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -62.75 -43.4 98.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.884 -0.326 . . . . 526.93 110.232 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.62 -48.23 80.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.956 -0.565 . . . . 162.88 110.526 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.417 HG11 ' CZ ' ' A' ' 101' ' ' PHE . 69.2 t -61.76 -42.19 93.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-N 115.52 -0.764 . . . . 139.01 111.408 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -58.89 -45.77 89.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.688 -0.233 . . . . 198.61 111.456 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 89.0 mtm180 -65.1 -42.13 94.33 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.943 -0.303 . . . . 999.99 111.211 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.97 -40.94 95.75 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.214 0.531 . . . . 799.65 110.57 178.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -61.21 -46.3 91.02 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.295 -0.866 . . . . 151.58 110.415 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 42.3 ttp -60.43 -40.07 89.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.617 -0.719 . . . . 168.43 110.998 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 76.6 mt-30 -61.99 -39.79 93.44 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 112.584 0.587 . . . . 530.56 112.584 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 74.1 p -65.51 -41.74 92.84 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.681 -0.408 . . . . 293.49 111.584 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 77.9 m-70 -71.06 -40.14 71.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.859 0.362 . . . . 383.72 110.775 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' A' ' 66' ' ' MET . 69.3 t-105 -62.12 -46.02 90.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.882 -0.599 . . . . 497.0 110.944 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -39.91 83.56 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.22 -0.445 . . . . 177.0 111.567 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -60.6 -45.4 94.13 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.269 -0.423 . . . . 478.76 111.005 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 57.1 m-85 -68.45 -39.29 81.52 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.269 -0.423 . . . . 727.09 111.199 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' TRP . 92.9 mmm -55.24 -41.17 71.76 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.413 0.523 . . . . 664.46 112.413 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.72 -47.71 84.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.826 0.346 . . . . 447.74 110.473 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.2 t90 -64.96 -45.94 83.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.071 -0.513 . . . . 999.99 110.828 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.6 -46.82 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.734 -0.666 . . . . 398.95 111.89 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -61.86 -40.97 97.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.831 -0.168 . . . . 366.97 111.435 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -62.45 -45.88 91.06 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.442 -0.345 . . . . 709.01 110.657 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -62.11 -46.55 88.53 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.019 -0.537 . . . . 931.14 111.075 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.93 -44.25 99.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.1 -0.5 . . . . 175.26 111.118 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -60.43 -44.18 96.05 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.344 -0.389 . . . . 443.19 111.222 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.48 97.17 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.492 -0.322 . . . . 366.44 111.476 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.01 -40.34 75.31 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.364 -0.38 . . . . 386.93 111.494 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.61 -4.91 85.08 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 116.068 -0.515 . . . . 244.67 112.351 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -75.6 154.71 36.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 999.99 111.435 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.7 p -110.44 95.68 23.67 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 263.29 110.394 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.77 151.89 57.93 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.799 2.333 . . . . 173.89 113.703 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.6 m -100.79 -176.5 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.605 -0.725 . . . . 201.66 110.863 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.428 ' O ' HG23 ' A' ' 86' ' ' THR . 70.9 t -60.03 -42.24 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.384 -0.371 . . . . 81.09 111.01 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.05 96.12 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.848 -0.692 . . . . 106.63 112.814 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.52 -41.89 96.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.078 0.466 . . . . 397.23 110.348 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 19' ' ' LEU . 38.0 m-85 -67.14 -37.56 84.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.611 -0.722 . . . . 176.41 112.032 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 82' ' ' VAL . 70.3 p -64.96 -28.54 69.59 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.376 0.51 . . . . 224.32 112.376 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.3 ttp-105 -61.85 -46.35 89.81 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.579 -0.526 . . . . 999.99 109.579 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.83 -40.08 83.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.545 -0.752 . . . . 158.17 110.393 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.78 98.22 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.605 -0.725 . . . . 65.71 112.902 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.15 -40.61 94.5 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.543 0.211 . . . . 95.38 111.097 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.76 -40.23 94.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.271 -0.422 . . . . 381.14 110.408 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.69 -43.64 98.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.854 -0.612 . . . . 182.12 110.558 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.97 -21.21 65.43 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.884 -0.598 . . . . 88.8 113.447 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 85.7 mtp180 -80.14 -17.04 53.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.892 0.346 . . . . 999.99 111.196 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -109.2 112.73 25.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 999.99 110.725 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.3 pt -130.3 156.22 42.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.877 0.37 . . . . 308.67 111.079 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -141.01 34.12 1.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.247 0.546 . . . . 388.05 110.094 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 99.2 mtp -66.77 -34.26 77.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.427 -0.806 . . . . 360.57 111.578 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.453 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -59.6 -38.32 80.95 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.253 -0.431 . . . . 184.23 110.941 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.1 -42.0 93.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.636 -0.711 . . . . 999.99 110.59 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.417 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 85.4 t80 -58.02 -47.33 83.39 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.967 -0.56 . . . . 374.13 111.505 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -60.41 -42.9 96.95 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.625 0.25 . . . . 999.99 110.939 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.69 -45.47 78.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.292 -0.413 . . . . 558.87 110.956 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.22 -40.18 96.73 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.866 -0.606 . . . . 332.85 112.088 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.59 -49.4 77.67 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.516 -0.311 . . . . 472.21 110.705 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -63.7 -39.27 93.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.814 0.34 . . . . 821.44 111.093 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.96 -39.88 79.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.921 -0.582 . . . . 746.24 111.817 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -82.55 -11.29 58.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.896 0.332 . . . . 999.99 111.896 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 53.51 43.03 31.81 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.394 0.434 . . . . 675.44 111.79 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -118.27 121.61 40.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.746 0.308 . . . . 999.99 110.52 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.3 mt -94.66 116.42 66.37 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.421 -0.354 . . . . 390.38 110.226 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.56 136.41 71.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.651 2.234 . . . . 243.11 112.617 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -85.46 134.42 34.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 618.1 110.579 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.592 ' HB2' HG13 ' A' ' 45' ' ' VAL . 72.8 t80 -68.24 116.99 9.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.795 0.331 . . . . 999.99 110.551 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.9 mt -99.38 147.67 33.64 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.404 . . . . 415.25 110.772 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.03 -28.61 66.0 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.542 2.161 . . . . 529.15 112.098 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.23 -37.91 89.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.861 -0.609 . . . . 516.88 110.813 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.0 mtt -59.6 -42.05 91.69 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-N 116.049 -0.523 . . . . 914.6 110.4 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -61.81 -44.72 96.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.125 -0.489 . . . . 675.31 110.817 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.63 -45.05 88.49 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.899 -0.592 . . . . 900.95 112.462 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.421 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 17.8 tt -72.91 -25.18 21.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 120.735 0.302 . . . . 300.73 111.719 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.13 -37.99 87.24 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.97 0.414 . . . . 595.29 111.139 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -85.44 -0.7 55.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 999.99 111.785 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 121' ' ' ILE . 99.0 mtp -90.15 125.66 35.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.606 0.241 . . . . 385.68 111.291 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.507 ' O ' HG23 ' A' ' 129' ' ' VAL . 99.5 mtt180 -53.19 141.48 40.63 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-N 115.982 -0.554 . . . . 999.99 111.035 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.56 -36.63 81.2 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.982 2.454 . . . . 149.6 112.715 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.6 -34.86 76.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.923 -0.58 . . . . 147.02 111.781 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.85 0.27 57.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.229 0.455 . . . . 360.37 112.229 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.3 t -85.57 117.02 67.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.749 0.309 . . . . 187.93 110.624 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.35 155.58 55.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.573 2.182 . . . . 265.39 112.889 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.5 t -113.77 136.86 48.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 246.78 109.843 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -115.49 131.49 56.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.85 0.357 . . . . 999.99 111.317 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -81.35 152.23 27.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 495.41 110.565 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.7 mtp . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.22 -0.895 . . . . 761.34 110.667 -179.699 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 49.8 mmm-85 . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 120.548 0.213 . . . . 999.99 111.306 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m 54.41 -118.52 1.32 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.876 -0.602 . . . . 999.99 111.558 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.5 174.49 14.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.415 . . . . 999.99 109.878 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -105.17 166.39 10.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.798 0.332 . . . . 999.99 111.308 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -67.87 -28.21 67.34 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.828 -0.624 . . . . 999.99 110.722 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.9 t -99.89 131.46 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.749 -0.659 . . . . 375.52 109.653 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 46.3 mp0 -80.21 121.33 81.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 999.99 110.77 -178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 47.8 Cg_exo -60.23 141.91 97.03 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.002 2.468 . . . . 436.63 112.709 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -74.36 143.94 44.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.511 . . . . 999.99 110.295 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -91.23 102.91 15.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.936 0.398 . . . . 999.99 110.718 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.0 mp -57.82 149.66 21.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.638 -0.71 . . . . 781.6 111.509 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -65.2 145.73 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.877 -0.416 . . . . 216.75 109.877 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.25 -45.14 91.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.615 -0.266 . . . . 902.9 111.187 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.35 88.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.5 -0.318 . . . . 121.35 111.615 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -67.89 -35.22 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 265.05 110.213 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 95.8 mt-10 -65.18 -38.9 91.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.822 -0.626 . . . . 524.44 110.161 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.1 -45.6 95.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.823 -0.626 . . . . 214.56 111.104 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.12 98.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.898 -0.592 . . . . 61.91 111.001 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.5 mt -69.05 -38.85 79.35 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.939 -0.573 . . . . 321.59 111.948 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 62.4 mtpt -60.74 -39.37 88.43 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.39 0.515 . . . . 491.97 112.39 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.81 -44.66 99.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.709 0.29 . . . . 179.68 110.841 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.96 -40.29 91.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.415 -0.357 . . . . 483.12 111.335 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.88 -45.05 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 120.918 0.39 . . . . 120.91 110.829 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.96 -42.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 115.886 -0.597 . . . . 324.41 111.323 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.32 95.72 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 121.115 -0.234 . . . . 76.38 111.138 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.72 -42.6 95.2 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.81 -0.71 . . . . 59.56 112.653 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -71.61 -19.61 62.09 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.626 0.37 . . . . 169.43 111.916 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.39 -29.01 56.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.828 -0.169 . . . . 145.09 110.887 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.59 -40.56 97.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 779.77 110.56 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.21 -29.53 40.7 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.703 -0.76 . . . . 72.33 112.492 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.5 -43.13 95.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.927 0.343 . . . . 213.67 111.927 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.448 ' HA ' HD12 ' A' ' 35' ' ' LEU . 26.8 m -64.72 -26.09 39.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 112.388 0.514 . . . . 275.82 112.388 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.84 -43.12 99.49 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.551 0.215 . . . . 545.0 110.85 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -72.2 -35.78 69.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.061 0.457 . . . . 999.99 110.439 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 32' ' ' VAL . 93.0 mt -62.91 -38.43 90.91 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.524 -0.762 . . . . 205.93 111.555 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -68.88 -24.02 64.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.661 0.245 . . . . 557.46 111.661 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.6 t -85.75 -46.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 112.233 0.457 . . . . 284.57 112.233 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -101.29 8.51 42.4 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.421 0.526 . . . . 350.44 112.421 -178.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.48 -26.54 69.72 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 121.483 -0.389 . . . . 199.7 113.827 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -61.61 -40.2 93.97 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.772 0.286 . . . . 999.99 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.0 p -112.96 14.18 19.65 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.037 0.384 . . . . 302.8 112.037 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.4 tp -71.12 123.53 22.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.983 0.42 . . . . 581.97 111.515 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.4 m -79.59 159.98 26.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.966 -0.561 . . . . 239.07 110.865 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.7 m -60.92 -44.98 96.44 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.335 -0.393 . . . . 192.01 111.456 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 45' ' ' VAL . 1.3 m -71.03 -29.44 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 112.256 0.465 . . . . 278.45 112.256 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.69 -40.08 94.77 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 121.216 -0.194 . . . . 316.42 110.987 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.9 tttp -61.38 -46.68 89.19 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.86 0.362 . . . . 470.35 110.136 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.953 -0.567 . . . . 369.78 110.649 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.54 90.52 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 115.848 -0.615 . . . . 66.79 110.755 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.05 -39.12 93.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.084 -0.507 . . . . 238.3 111.336 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.475 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 43.4 m-85 -63.18 -38.94 93.17 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 109.249 -0.648 . . . . 526.93 109.249 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -61.09 -47.57 85.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.454 -0.793 . . . . 162.88 109.678 177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.5 t -62.86 -41.94 94.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 115.991 -0.55 . . . . 139.01 110.288 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -59.43 -43.1 93.14 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.949 -0.569 . . . . 198.61 111.053 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HG2' HE21 ' A' ' 59' ' ' GLN . 48.2 ttp180 -61.04 -46.97 88.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.824 0.345 . . . . 999.99 110.508 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -62.74 -44.57 95.86 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.974 -0.557 . . . . 799.65 110.464 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.22 -48.11 83.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.505 -0.77 . . . . 151.58 111.232 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 43.9 ttp -60.74 -45.67 93.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.202 -0.453 . . . . 168.43 111.379 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.411 HE21 ' HG2' ' A' ' 55' ' ' ARG . 75.3 mt-30 -64.82 -41.12 96.02 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.062 -0.255 . . . . 530.56 111.063 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -63.68 -45.94 87.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.374 -0.375 . . . . 293.49 110.693 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -62.55 -46.28 89.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.894 -0.594 . . . . 383.72 110.132 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -61.51 -47.76 84.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.818 -0.628 . . . . 497.0 111.304 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.93 93.57 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.419 0.525 . . . . 177.0 112.419 -179.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -63.69 -43.38 96.79 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.187 -0.301 . . . . 478.76 110.187 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -65.44 -44.26 87.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.185 -0.461 . . . . 727.09 110.185 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 tpt -53.53 -45.35 69.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.428 -0.805 . . . . 664.46 111.806 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.2 mp -60.88 -40.92 94.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.657 0.243 . . . . 447.74 111.657 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -63.04 -47.2 84.04 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.398 -0.364 . . . . 999.99 111.758 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 44.8 pt -77.44 -23.05 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.259 0.466 . . . . 398.95 112.259 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -58.99 -39.24 81.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.464 -0.335 . . . . 366.97 111.414 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.99 -43.26 99.12 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.665 0.269 . . . . 709.01 110.753 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -66.0 -45.08 82.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.255 -0.429 . . . . 931.14 110.758 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 37.8 mm -62.85 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.816 -0.629 . . . . 175.26 111.327 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -62.04 -43.61 98.46 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.31 -0.404 . . . . 443.19 111.368 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.45 97.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.498 -0.319 . . . . 366.44 111.462 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.15 -40.67 78.07 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.894 0.378 . . . . 386.93 111.168 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.91 -9.77 75.29 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.053 -0.521 . . . . 244.67 112.675 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -75.26 147.79 39.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.377 . . . . 999.99 111.338 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 12.1 p -102.02 106.3 46.92 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 263.29 110.51 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.11 145.4 49.33 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.628 2.219 . . . . 173.89 113.473 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.7 m -101.66 -175.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 201.66 111.236 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.61 -40.58 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.333 -0.394 . . . . 81.09 110.81 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.631 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.09 -40.29 96.92 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.889 -0.672 . . . . 106.63 112.641 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.9 -42.66 80.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.086 0.469 . . . . 397.23 110.612 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -68.2 -35.49 78.07 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.856 -0.611 . . . . 176.41 112.236 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.631 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -59.8 -34.64 73.3 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.453 0.168 . . . . 224.32 111.453 -179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.98 -41.16 95.67 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.062 0.458 . . . . 999.99 109.898 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.22 -39.81 78.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.494 -0.776 . . . . 158.17 110.265 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -39.52 97.69 Favored Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.421 -0.809 . . . . 65.71 112.535 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.18 92.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.596 0.236 . . . . 95.38 110.67 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -64.78 -40.43 95.24 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.102 -0.499 . . . . 381.14 110.25 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.65 -43.24 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.639 -0.71 . . . . 182.12 110.589 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.72 -22.37 64.07 Favored Glycine 0 CA--C 1.52 0.394 0 CA-C-N 115.895 -0.593 . . . . 88.8 113.429 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.5 mmt-85 -80.08 -18.56 49.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.896 0.348 . . . . 999.99 111.191 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.1 mmt85 -108.47 111.98 24.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 999.99 110.379 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 60.4 mt -124.66 126.17 71.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.844 -0.428 . . . . 308.67 109.844 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.35 32.23 5.71 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.971 -0.292 . . . . 388.05 111.633 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 77.7 mtm -70.0 -28.73 65.74 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.556 -0.293 . . . . 360.57 111.039 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.79 -37.96 80.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.016 -0.538 . . . . 184.23 110.777 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -59.83 -42.21 93.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.665 -0.698 . . . . 999.99 110.368 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.94 -46.78 84.53 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.821 -0.627 . . . . 374.13 111.12 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -60.12 -44.37 94.95 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.536 0.208 . . . . 999.99 110.799 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.21 -42.74 93.18 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.455 -0.339 . . . . 558.87 111.126 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.85 96.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.063 -0.517 . . . . 332.85 111.574 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.97 -46.22 90.21 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.887 -0.597 . . . . 472.21 110.852 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.73 -39.31 93.98 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.307 -0.406 . . . . 821.44 111.352 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.73 -38.91 79.41 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.196 -0.456 . . . . 746.24 111.879 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -83.09 -11.65 57.8 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.601 -0.272 . . . . 999.99 111.385 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 54.98 39.89 31.8 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.563 0.539 . . . . 675.44 111.615 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.2 ttp -107.72 124.0 49.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.337 -0.392 . . . . 999.99 110.874 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.3 mt -94.11 117.12 67.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.378 -0.374 . . . . 390.38 110.373 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -59.78 142.02 97.89 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.821 2.347 . . . . 243.11 112.421 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -84.79 119.49 25.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 618.1 110.403 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -70.07 116.5 10.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.058 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.702 ' O ' ' HG2' ' A' ' 118' ' ' MET . 3.4 mm? -99.04 129.96 28.45 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.488 . . . . 415.25 111.243 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.1 Cg_exo -58.5 -31.9 95.3 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.733 2.289 . . . . 529.15 112.565 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -61.22 -40.89 95.68 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.931 0.715 . . . . 516.88 112.931 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' MET . . . . . 0.702 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 24.8 ptt? -55.39 -22.46 19.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.551 0.575 . . . . 914.6 112.551 -178.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.13 -39.09 88.7 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.144 0.497 . . . . 675.31 110.337 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -67.75 -37.23 81.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.755 -0.657 . . . . 900.95 111.147 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.2 mt -60.34 -46.25 95.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.761 0.652 . . . . 300.73 112.761 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -80.46 -9.84 59.75 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.208 -0.597 . . . . 595.29 111.232 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -87.98 -32.77 18.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.822 0.344 . . . . 999.99 110.923 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 ptp -77.7 148.32 35.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.032 0.444 . . . . 385.68 111.855 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 125' ' ' ARG . 42.5 ttm105 -51.96 128.69 37.96 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-N 115.371 -0.831 . . . . 999.99 111.572 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.19 -35.32 90.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.096 2.531 . . . . 149.6 112.895 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.13 -24.14 67.76 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.119 -0.491 . . . . 147.02 112.117 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.73 -0.93 57.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.622 -0.263 . . . . 360.37 111.563 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.2 t -88.0 119.23 70.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.688 0.28 . . . . 187.93 110.829 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.17 156.98 58.52 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.826 2.351 . . . . 265.39 112.749 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.408 HG13 ' HG2' ' A' ' 59' ' ' GLN . 93.9 t -118.73 137.45 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.057 -0.52 . . . . 246.78 110.53 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -114.57 129.79 56.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.505 -0.316 . . . . 999.99 110.425 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -82.69 75.28 9.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.938 0.399 . . . . 495.41 110.91 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.5 mtm . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.25 -0.881 . . . . 761.34 110.995 179.767 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 71.4 mtt85 . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 120.818 0.342 . . . . 999.99 110.335 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 m -92.11 -2.01 56.85 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.081 0.4 . . . . 999.99 112.081 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -102.78 129.45 49.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.812 0.339 . . . . 999.99 110.866 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -111.0 15.43 21.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 999.99 111.209 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -107.62 -111.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.463 -0.335 . . . . 999.99 110.73 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.1 m -129.67 153.87 39.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.751 0.31 . . . . 375.52 110.659 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -81.15 156.97 71.52 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.447 . . . . 999.99 110.829 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.78 139.76 90.04 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.639 2.226 . . . . 436.63 111.933 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -121.86 -51.26 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.868 0.322 . . . . 999.99 111.868 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -101.02 3.22 41.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.81 0.3 . . . . 999.99 111.81 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 11' ' ' LEU . 1.8 mm? -57.97 113.62 1.97 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.826 0.346 . . . . 781.6 111.492 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -114.24 152.07 31.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 216.75 110.969 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.34 -41.72 97.51 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.218 -0.446 . . . . 902.9 110.557 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.56 -38.79 82.06 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.932 -0.576 . . . . 121.35 111.405 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -63.08 -37.98 89.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 265.05 109.876 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.21 -44.07 96.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.855 -0.611 . . . . 524.44 110.271 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.89 -45.81 97.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.609 -0.723 . . . . 214.56 111.242 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.19 90.63 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.058 -0.519 . . . . 61.91 111.164 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 85' ' ' TYR . 76.1 mt -62.02 -42.37 99.09 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.35 -0.386 . . . . 321.59 110.715 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' O ' HG12 ' A' ' 24' ' ' ILE . 31.7 mmmt -61.98 -39.81 93.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.383 -0.371 . . . . 491.97 111.353 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 76.4 t -64.0 -46.64 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.669 -0.241 . . . . 179.68 110.994 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -68.41 -42.72 78.56 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.907 0.384 . . . . 483.12 111.034 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.444 HD13 ' SD ' ' A' ' 58' ' ' MET . 83.6 mt -63.8 -46.73 93.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.728 -0.669 . . . . 120.91 112.432 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 20' ' ' LYS . 30.1 mm -61.02 -45.98 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 121.044 -0.263 . . . . 324.41 111.058 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.51 92.28 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.768 0.285 . . . . 76.38 111.768 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.52 -45.25 90.78 Favored Glycine 0 C--N 1.335 0.521 0 C-N-CA 120.938 -0.649 . . . . 59.56 113.683 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CD1' HG23 ' A' ' 23' ' ' ILE . 46.6 m-85 -73.2 -20.79 60.8 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.017 0.377 . . . . 169.43 112.017 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.0 t70 -75.9 -38.14 58.07 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.827 -0.17 . . . . 145.09 111.17 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 tpp85 -60.56 -45.82 92.49 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.833 -0.432 . . . . 779.77 109.833 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.427 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.47 -40.09 98.2 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.761 -0.654 . . . . 72.33 112.387 178.528 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.33 -39.46 94.61 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.573 0.225 . . . . 213.67 111.122 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 28' ' ' ASP . 57.6 t -59.8 -40.09 81.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.137 -0.483 . . . . 275.82 111.76 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.17 -41.6 93.17 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 111.653 0.242 . . . . 545.0 111.653 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.427 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 7.3 m-90 -80.74 -36.95 31.37 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.687 0.28 . . . . 999.99 111.49 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.8 mt -64.74 -38.37 90.75 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.536 0.569 . . . . 205.93 112.536 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -64.13 -18.82 64.8 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.449 0.537 . . . . 557.46 112.449 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.1 t -84.71 -42.92 17.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.741 0.305 . . . . 284.57 111.699 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -104.25 11.96 34.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.753 0.311 . . . . 350.44 111.555 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.18 -20.14 68.87 Favored Glycine 0 CA--C 1.517 0.195 0 CA-C-N 116.049 -0.523 . . . . 199.7 114.359 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -61.31 -40.84 95.67 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.038 0.419 . . . . 999.99 111.662 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.6 p -113.4 9.99 18.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.911 0.338 . . . . 302.8 111.911 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.6 tp -71.75 123.35 22.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.986 0.422 . . . . 581.97 111.946 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.5 m -79.77 157.93 26.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 239.07 110.454 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 94.2 m -60.93 -44.36 97.34 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.803 0.335 . . . . 192.01 111.183 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.39 -31.75 52.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.263 -0.426 . . . . 278.45 112.068 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.92 -41.97 90.7 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.867 0.365 . . . . 316.42 110.282 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.493 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.7 tttp -62.86 -46.42 87.95 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.808 -0.633 . . . . 470.35 110.229 178.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.18 -40.72 98.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.395 -0.821 . . . . 369.78 111.252 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.37 95.71 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.169 -0.469 . . . . 66.79 111.626 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.25 -39.11 93.28 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.29 -0.414 . . . . 238.3 112.0 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.493 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 36.3 m-85 -63.5 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.829 -0.434 . . . . 526.93 109.829 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -62.27 -47.14 85.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.622 -0.717 . . . . 162.88 111.341 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.25 -26.81 23.04 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 C-N-CA 120.5 -0.48 . . . . 139.01 111.366 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.12 -44.36 96.81 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.859 0.362 . . . . 198.61 110.307 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtm-85 -64.99 -38.64 91.62 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.875 -0.602 . . . . 999.99 110.975 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -60.24 -45.39 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.33 -0.395 . . . . 799.65 109.973 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -59.63 -47.7 84.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.893 -0.594 . . . . 151.58 110.437 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.444 ' SD ' HD13 ' A' ' 23' ' ' ILE . 18.6 tmm? -59.99 -46.18 90.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 168.43 111.263 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -62.82 -40.96 99.01 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 112.034 0.383 . . . . 530.56 112.034 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.9 p -69.91 -39.34 76.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.84 -0.344 . . . . 293.49 111.476 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -71.98 -42.82 66.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.901 0.381 . . . . 383.72 110.79 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -62.59 -40.17 96.04 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.83 -0.623 . . . . 497.0 111.961 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.84 -40.81 80.95 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.096 0.406 . . . . 177.0 112.096 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -63.66 -42.24 98.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.691 0.281 . . . . 478.76 111.03 179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.06 -39.96 68.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.401 -0.363 . . . . 727.09 111.344 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 tpt -52.53 -43.09 64.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.81 -0.632 . . . . 664.46 112.16 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.67 -43.54 98.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.675 -0.239 . . . . 447.74 111.281 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.22 -40.03 78.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.942 0.401 . . . . 999.99 110.855 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.566 HD13 HD13 ' A' ' 88' ' ' LEU . 96.9 mt -63.14 -44.97 99.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.759 -0.655 . . . . 398.95 110.64 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.03 -41.81 97.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.017 -0.538 . . . . 366.97 110.925 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -62.56 -43.14 99.55 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.616 -0.265 . . . . 709.01 110.873 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.41 -47.46 81.89 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.164 -0.471 . . . . 931.14 111.136 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.41 -45.75 97.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.186 -0.461 . . . . 175.26 111.076 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.203 -0.453 . . . . 443.19 111.449 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.46 97.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.375 -0.375 . . . . 366.44 111.716 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.16 -40.99 77.84 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.909 0.385 . . . . 386.93 111.247 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.72 -8.89 78.19 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 121.155 -0.545 . . . . 244.67 112.733 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -75.2 145.1 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.74 0.305 . . . . 999.99 111.354 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 34.8 p -83.88 120.54 75.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.441 -0.345 . . . . 263.29 110.67 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.98 146.52 37.32 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.498 2.132 . . . . 173.89 112.987 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 m -102.57 169.84 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 201.66 111.158 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.64 -40.48 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.204 -0.453 . . . . 81.09 111.205 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.43 -39.07 94.39 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.152 -0.547 . . . . 106.63 112.94 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.77 -40.53 95.48 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.826 0.346 . . . . 397.23 110.527 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 19' ' ' LEU . 48.9 m-85 -67.92 -40.09 83.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.085 -0.507 . . . . 176.41 111.563 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.3 p -68.26 -34.69 76.65 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.004 -0.278 . . . . 224.32 111.075 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -62.77 -45.2 93.79 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.958 0.408 . . . . 999.99 109.985 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 69' ' ' ILE . 86.2 mt -64.16 -41.33 97.19 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.702 -0.681 . . . . 158.17 110.785 179.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.95 -40.27 99.08 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.992 -0.549 . . . . 65.71 112.432 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.46 92.78 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.671 0.272 . . . . 95.38 111.247 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.01 -39.95 90.7 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.099 0.476 . . . . 381.14 110.734 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.76 -40.05 86.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.545 -0.752 . . . . 182.12 110.943 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.413 ' HA2' ' CE1' ' A' ' 27' ' ' PHE . . . -64.76 -14.14 57.66 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.875 -0.602 . . . . 88.8 114.162 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -78.25 -22.35 48.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.178 0.489 . . . . 999.99 111.441 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -109.01 115.43 30.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.899 0.381 . . . . 999.99 110.842 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.0 pt -131.85 153.04 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 120.876 0.37 . . . . 308.67 111.225 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.8 p-10 -116.24 20.73 14.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 388.05 110.703 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.96 -39.36 91.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.556 . . . . 360.57 111.627 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.26 96.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.895 0.379 . . . . 184.23 110.634 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -69.08 -40.14 78.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.738 -0.665 . . . . 999.99 110.53 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.71 -49.08 79.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.005 -0.543 . . . . 374.13 110.73 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -60.52 -48.3 82.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.067 -0.515 . . . . 999.99 110.869 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.21 -45.91 91.24 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.139 -0.482 . . . . 558.87 111.501 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.9 -40.79 98.63 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.551 -0.295 . . . . 332.85 111.695 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.474 HD11 ' HD3' ' A' ' 112' ' ' PRO . 61.1 tp -61.35 -47.39 86.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.294 -0.412 . . . . 472.21 110.573 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -66.71 -39.03 87.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.197 -0.456 . . . . 821.44 111.017 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.05 -40.63 81.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.92 -0.582 . . . . 746.24 111.953 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -82.52 -11.38 58.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.626 -0.261 . . . . 999.99 111.466 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.8 t30 55.01 44.28 28.46 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.189 0.518 . . . . 675.44 111.699 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 26.5 mmt -117.45 128.74 55.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 999.99 110.534 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.63 116.6 66.56 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.534 -0.303 . . . . 390.38 110.67 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.474 ' HD3' HD11 ' A' ' 105' ' ' LEU . 73.2 Cg_endo -73.53 154.86 50.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.467 2.112 . . . . 243.11 112.312 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -81.7 121.43 26.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.774 0.321 . . . . 618.1 110.231 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -69.26 138.38 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.041 -0.527 . . . . 999.99 110.846 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 83.4 mt -99.24 112.72 63.82 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 415.25 112.011 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -60.45 -27.58 85.13 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.119 2.546 . . . . 529.15 111.996 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -60.57 -26.43 66.93 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.119 -0.946 . . . . 516.88 111.556 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 30.8 mmm -57.18 -28.24 62.62 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.443 0.534 . . . . 914.6 112.443 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -60.2 -44.24 95.27 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.024 -0.361 . . . . 675.31 110.024 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -67.43 -39.19 85.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.064 -0.516 . . . . 900.95 110.821 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.51 -45.05 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.164 -0.471 . . . . 300.73 110.865 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -61.13 -40.11 92.54 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.97 -0.559 . . . . 595.29 111.288 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -67.37 -33.27 74.87 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.202 0.445 . . . . 999.99 112.202 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.4 mtp -76.76 129.74 36.72 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.301 0.482 . . . . 385.68 112.301 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -54.04 147.82 23.84 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 115.537 -0.756 . . . . 999.99 111.441 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.1 -28.2 86.51 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.758 2.306 . . . . 149.6 112.522 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.48 -31.32 72.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.168 -0.469 . . . . 147.02 111.291 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.21 -0.06 57.62 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.073 -0.512 . . . . 360.37 111.696 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.2 t -90.53 115.38 64.03 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.656 0.265 . . . . 187.93 110.636 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.9 159.46 48.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.786 2.324 . . . . 265.39 112.773 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -116.59 136.81 52.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 246.78 109.539 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -113.27 120.83 42.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.926 0.394 . . . . 999.99 111.358 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -84.17 163.37 19.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.825 -0.625 . . . . 495.41 110.23 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.2 mmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.282 -0.866 . . . . 761.34 110.685 -179.502 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.531 0.205 . . . . 999.99 110.771 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.1 t -150.01 119.03 6.69 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.253 -0.179 . . . . 999.99 110.554 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 44.6 m0 56.05 34.65 24.16 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.503 0.502 . . . . 999.99 112.219 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.4 m170 -99.15 5.07 46.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.724 0.297 . . . . 999.99 111.411 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.67 -90.35 0.52 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.436 -0.347 . . . . 999.99 110.782 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.6 t -124.75 126.95 72.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.525 -0.307 . . . . 375.52 110.7 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -82.27 124.95 77.88 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 999.99 110.363 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.06 141.16 43.3 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.439 2.093 . . . . 436.63 112.835 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -132.04 148.6 52.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.002 -0.545 . . . . 999.99 110.467 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 56.33 43.14 26.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.607 0.567 . . . . 999.99 112.052 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.52 137.02 49.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.268 -0.424 . . . . 781.6 111.251 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -88.04 104.31 16.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.404 . . . . 216.75 110.316 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -63.33 -39.16 93.77 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.775 -0.648 . . . . 902.9 112.166 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -41.31 90.72 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.738 0.304 . . . . 121.35 111.741 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -67.71 -33.91 75.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 265.05 109.932 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 96.5 mt-10 -64.98 -40.45 94.99 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.737 -0.665 . . . . 524.44 110.27 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.58 -46.44 96.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 115.955 -0.566 . . . . 214.56 111.037 179.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.45 92.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.927 -0.579 . . . . 61.91 110.322 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.2 tp -64.11 -39.27 93.67 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.409 -0.814 . . . . 321.59 110.898 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 98.4 mttt -59.22 -37.08 76.63 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.907 -0.588 . . . . 491.97 111.671 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.51 -43.76 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 179.68 110.461 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -68.56 -39.69 80.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.892 0.377 . . . . 483.12 110.554 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.78 -47.4 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.689 -0.687 . . . . 120.91 112.84 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 pt -63.33 -37.39 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 N-CA-C 112.577 0.584 . . . . 324.41 112.577 -178.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.81 91.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.637 0.256 . . . . 76.38 111.441 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.43 -41.91 65.89 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.023 -0.608 . . . . 59.56 113.2 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -73.01 -19.02 61.28 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.731 0.641 . . . . 169.43 112.731 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -75.01 -36.49 61.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.072 -0.251 . . . . 145.09 111.045 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -63.65 -40.53 97.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.929 0.395 . . . . 779.77 110.191 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.65 -39.36 97.46 Favored Glycine 0 C--N 1.333 0.384 0 CA-C-N 115.701 -0.681 . . . . 72.33 112.177 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' SD ' ' A' ' 98' ' ' MET . 83.7 mt -62.63 -40.67 97.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.717 0.294 . . . . 213.67 110.608 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.7 t -61.38 -42.79 95.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.789 -0.641 . . . . 275.82 111.36 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 68.5 mttm -61.38 -41.51 97.23 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.532 -0.304 . . . . 545.0 111.418 -179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -70.62 -43.9 68.34 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.287 0.565 . . . . 999.99 110.211 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 97.2 mt -63.27 -38.97 93.23 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.341 -0.845 . . . . 205.93 113.163 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -63.9 -18.65 64.42 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.508 0.558 . . . . 557.46 112.508 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -84.92 -44.99 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 112.031 0.382 . . . . 284.57 112.031 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -103.28 9.57 38.01 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.773 0.321 . . . . 350.44 111.775 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.99 -21.29 63.45 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.559 0.584 . . . . 199.7 114.559 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.49 -41.19 96.89 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 117.187 0.494 . . . . 999.99 111.696 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.7 p -113.69 10.23 17.92 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.911 0.337 . . . . 302.8 111.911 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.8 tp -71.64 124.58 25.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.126 0.417 . . . . 581.97 112.126 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.2 m -78.98 158.67 27.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 239.07 110.305 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -60.91 -44.78 96.68 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.664 0.269 . . . . 192.01 111.575 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.08 -31.76 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 N-CA-C 112.075 0.398 . . . . 278.45 112.075 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -64.9 -40.15 94.64 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.536 0.208 . . . . 316.42 110.82 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 29.3 ttpp -61.37 -45.86 92.61 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.26 -0.427 . . . . 470.35 110.43 179.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -65.22 -39.66 93.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.045 -0.525 . . . . 369.78 110.674 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.74 92.65 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.877 -0.602 . . . . 66.79 111.295 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.42 -38.58 91.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.095 -0.502 . . . . 238.3 111.785 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.438 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 23.3 m-85 -61.66 -38.96 89.69 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.505 -0.554 . . . . 526.93 109.505 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -65.29 -41.75 93.82 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.674 -0.694 . . . . 162.88 109.74 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.6 t -62.43 -40.4 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.041 -0.527 . . . . 139.01 110.339 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -58.86 -39.42 81.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.561 -0.745 . . . . 198.61 110.963 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.7 mmm-85 -61.77 -42.23 98.72 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.722 -0.217 . . . . 999.99 110.583 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.35 -40.8 96.58 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.06 0.457 . . . . 799.65 110.116 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -61.65 -48.18 82.04 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.608 -0.724 . . . . 151.58 110.93 178.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -60.52 -46.84 88.67 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.828 -0.624 . . . . 168.43 112.023 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -65.65 -33.54 76.12 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 120.733 -0.387 . . . . 530.56 111.145 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.0 m -66.1 -45.99 79.22 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.194 0.521 . . . . 293.49 110.214 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -64.29 -45.29 88.67 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.635 -0.711 . . . . 383.72 110.445 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -62.73 -43.53 98.56 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.666 -0.697 . . . . 497.0 111.845 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.99 78.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.125 0.417 . . . . 177.0 112.125 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -60.07 -49.75 76.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 478.76 110.889 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.431 ' O ' HG12 ' A' ' 69' ' ' ILE . 54.4 m-85 -72.17 -37.76 69.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.328 -0.396 . . . . 727.09 111.658 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -53.0 -46.21 68.22 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.433 0.458 . . . . 664.46 110.788 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.44 -44.44 96.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.989 -0.551 . . . . 447.74 111.276 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -66.91 -40.69 87.76 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.582 0.586 . . . . 999.99 112.582 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.3 pt -79.21 -25.51 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 N-CA-C 112.203 0.446 . . . . 398.95 112.203 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.52 -41.89 95.32 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.529 0.204 . . . . 366.97 110.813 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.6 -47.15 86.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.335 -0.393 . . . . 709.01 110.618 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -63.38 -46.75 85.02 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.928 -0.578 . . . . 931.14 111.286 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.15 -44.99 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.146 -0.479 . . . . 175.26 111.162 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -61.24 -43.85 98.21 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.314 -0.403 . . . . 443.19 111.269 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.02 -40.35 97.47 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.517 -0.311 . . . . 366.44 111.402 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.13 -39.57 82.69 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.295 -0.411 . . . . 386.93 111.253 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.65 -0.04 89.22 Favored Glycine 0 C--N 1.332 0.317 0 CA-C-N 116.0 -0.546 . . . . 244.67 112.508 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 17.2 mmp_? -75.16 149.7 38.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.907 0.384 . . . . 999.99 111.227 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.4 p -106.83 101.07 35.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 263.29 110.807 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 78' ' ' ARG . 43.1 Cg_exo -59.88 142.52 98.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.132 2.555 . . . . 173.89 112.931 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.428 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 15.7 m -100.26 -176.36 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.988 -0.551 . . . . 201.66 110.971 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.7 t -59.64 -43.46 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.39 -0.368 . . . . 81.09 111.082 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.11 -39.55 95.96 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.52 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -62.16 -41.28 98.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.896 0.379 . . . . 397.23 110.72 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.428 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 47.6 m-85 -68.38 -39.95 81.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.968 -0.56 . . . . 176.41 111.416 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.4 p -67.34 -36.0 80.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 111.633 0.234 . . . . 224.32 111.633 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.61 -47.16 84.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.215 0.531 . . . . 999.99 110.095 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 tp -67.99 -42.09 81.29 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.575 -0.739 . . . . 158.17 110.514 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.32 -39.39 97.16 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.763 -0.653 . . . . 65.71 113.042 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -60.77 -40.76 93.73 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.756 0.312 . . . . 95.38 110.869 179.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.4 -39.44 93.86 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.097 -0.501 . . . . 381.14 110.352 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.4 mm -63.9 -42.09 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.628 -0.715 . . . . 182.12 110.758 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -71.17 -9.35 67.11 Favored Glycine 0 CA--C 1.521 0.466 0 CA-C-N 115.842 -0.617 . . . . 88.8 113.995 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.3 mmm180 -77.72 -25.96 49.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.314 0.557 . . . . 999.99 111.331 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -108.53 112.15 24.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.891 0.376 . . . . 999.99 110.681 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 79.0 mt -125.68 125.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 308.67 110.591 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -137.44 65.67 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.883 0.373 . . . . 388.05 110.581 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.557 ' SD ' HD23 ' A' ' 31' ' ' LEU . 28.3 ptm -72.38 -21.12 61.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.987 -0.552 . . . . 360.57 110.755 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.27 89.82 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.886 -0.597 . . . . 184.23 110.681 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.22 -48.35 82.1 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.796 -0.638 . . . . 999.99 111.143 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -62.81 -44.06 97.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.354 -0.384 . . . . 374.13 110.301 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -60.67 -47.67 85.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.911 -0.586 . . . . 999.99 110.539 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.46 -41.68 97.59 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.762 -0.654 . . . . 558.87 111.062 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.07 98.08 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.387 -0.37 . . . . 332.85 111.209 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.95 -41.09 97.69 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.46 -0.336 . . . . 472.21 110.598 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -63.0 -44.53 95.77 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.807 -0.633 . . . . 821.44 111.158 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.78 -39.79 82.11 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.075 -0.512 . . . . 746.24 112.155 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -91.37 0.19 57.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.562 -0.29 . . . . 999.99 111.697 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 57.5 36.2 26.68 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.022 0.439 . . . . 675.44 111.21 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 16.7 mmt -100.19 79.39 2.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.167 0.508 . . . . 999.99 111.088 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 71.6 mt -93.65 120.67 65.96 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.896 -0.593 . . . . 390.38 110.17 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.91 149.93 66.63 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.366 2.044 . . . . 243.11 112.504 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -80.11 129.67 34.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 618.1 110.63 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -69.87 86.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.97 -0.559 . . . . 999.99 111.199 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.97 149.67 35.96 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 415.25 111.297 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.18 -25.22 65.27 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.737 2.292 . . . . 529.15 112.322 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -60.63 -45.14 95.17 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.04 -0.527 . . . . 516.88 111.338 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 96.8 mtp -59.99 -40.68 90.01 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.249 -0.432 . . . . 914.6 109.885 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.28 -40.43 96.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.777 -0.647 . . . . 675.31 110.374 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -62.97 -42.13 99.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.859 -0.61 . . . . 900.95 111.179 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.29 -44.49 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.68 0.276 . . . . 300.73 110.449 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -61.25 -41.81 97.55 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.059 -0.518 . . . . 595.29 111.346 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -65.63 -33.88 76.93 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.346 -0.388 . . . . 999.99 111.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.8 mtp -72.57 140.68 48.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 385.68 111.714 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.409 ' O ' HG23 ' A' ' 129' ' ' VAL . 91.3 mtm180 -52.38 141.3 33.13 Favored Pre-proline 0 C--O 1.234 0.281 0 CA-C-N 115.627 -0.715 . . . . 999.99 111.237 178.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -60.78 -25.73 81.67 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.677 2.251 . . . . 149.6 112.548 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.16 80.57 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.029 -0.532 . . . . 147.02 111.618 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.65 -2.54 57.85 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.339 -0.391 . . . . 360.37 111.934 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 125' ' ' ARG . 60.9 t -93.18 116.1 65.99 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.243 -0.28 . . . . 187.93 110.243 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.21 151.03 72.22 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.44 2.094 . . . . 265.39 112.752 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.1 t -109.06 137.43 41.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.913 -0.585 . . . . 246.78 110.134 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.1 141.93 47.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.829 0.347 . . . . 999.99 110.733 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -83.39 158.83 21.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 495.41 110.81 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.348 -0.834 . . . . 761.34 111.139 -179.12 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 . . . . . 0 N--CA 1.469 0.478 0 CA-C-O 121.374 0.607 . . . . 999.99 112.603 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.7 p -153.06 164.35 38.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.247 -0.888 . . . . 999.99 109.361 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.5 t-105 -115.96 -89.88 0.56 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 120.418 -0.513 . . . . 999.99 111.643 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -165.15 167.74 17.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.454 0.168 . . . . 999.99 110.968 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 70.35 -94.88 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.528 0 O-C-N 123.922 0.764 . . . . 999.99 111.967 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.7 t -115.46 120.64 65.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.919 0.39 . . . . 375.52 111.089 -179.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -91.52 119.98 68.38 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 999.99 110.562 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.44 139.38 34.48 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.295 1.996 . . . . 436.63 112.392 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -98.22 -11.33 22.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.963 0.411 . . . . 999.99 111.292 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -108.85 12.46 25.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 999.99 111.351 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.81 114.49 2.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.017 0.437 . . . . 781.6 111.602 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -114.91 126.77 55.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 216.75 110.037 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.54 -39.49 91.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.769 0.319 . . . . 902.9 110.841 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.77 87.87 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.242 -0.435 . . . . 121.35 111.412 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -68.23 -32.48 72.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.009 -0.541 . . . . 265.05 110.108 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -63.08 -41.61 99.46 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.738 -0.665 . . . . 524.44 109.961 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.12 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 115.803 -0.635 . . . . 214.56 111.033 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.16 -40.87 97.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.232 -0.44 . . . . 61.91 110.626 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.77 -43.01 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.823 -0.626 . . . . 321.59 110.312 178.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -59.72 -44.21 93.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.391 -0.822 . . . . 491.97 111.498 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.66 -42.82 97.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 179.68 111.69 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -63.9 -41.13 97.78 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.738 0.304 . . . . 483.12 111.177 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.263 -0.426 . . . . 120.91 110.582 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.59 -42.87 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 115.972 -0.558 . . . . 324.41 111.325 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.49 95.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.743 0.275 . . . . 76.38 111.743 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.98 -41.28 97.4 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 120.801 -0.714 . . . . 59.56 112.493 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -73.18 -19.6 61.07 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.726 0.41 . . . . 169.43 111.504 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -75.64 -34.67 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.315 . . . . 145.09 111.046 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.75 -44.23 96.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.998 0.428 . . . . 779.77 109.907 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.04 -37.59 94.14 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.533 -0.758 . . . . 72.33 112.521 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.83 -41.27 78.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.71 0.291 . . . . 213.67 110.403 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.9 -44.9 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.018 -0.537 . . . . 275.82 110.779 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 -40.14 95.07 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.756 0.312 . . . . 545.0 110.944 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.6 t90 -64.96 -42.0 94.99 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.315 -0.624 . . . . 999.99 109.315 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 83.6 mt -62.67 -36.68 83.65 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.332 -0.849 . . . . 205.93 111.293 179.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.13 -37.72 86.23 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.585 0.217 . . . . 557.46 111.585 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.2 t -87.01 -50.59 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 113.616 0.969 . . . . 284.57 113.616 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -99.77 -1.49 37.54 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.083 0.771 . . . . 350.44 113.083 -177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -73.51 -11.87 80.19 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 121.233 -0.508 . . . . 199.7 114.05 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.54 -41.17 96.95 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.91 0.355 . . . . 999.99 111.533 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 61.7 p -113.29 5.44 16.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.875 0.369 . . . . 302.8 111.694 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.4 tp -71.85 133.38 45.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.054 -0.521 . . . . 581.97 111.3 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -75.89 161.52 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.039 -0.528 . . . . 239.07 111.266 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.1 -44.54 94.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.998 -0.547 . . . . 192.01 111.913 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.48 -30.4 47.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.558 0.218 . . . . 278.45 111.352 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -67.04 -38.12 85.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.47 -0.332 . . . . 316.42 110.344 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -62.7 -40.41 97.04 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.074 0.464 . . . . 470.35 110.242 178.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -69.48 -33.01 72.26 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.627 -0.715 . . . . 369.78 110.784 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.33 76.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.833 -0.621 . . . . 66.79 111.639 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.0 mt -60.49 -39.18 86.74 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.832 0.308 . . . . 238.3 111.832 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -63.55 -39.04 93.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.916 -0.402 . . . . 526.93 109.916 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -70.11 -40.72 74.72 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.758 -0.655 . . . . 162.88 110.449 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.6 t -63.59 -40.49 89.25 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 N-CA-C 109.655 -0.498 . . . . 139.01 109.655 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -59.34 -39.82 84.41 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.455 -0.793 . . . . 198.61 110.52 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 ttt-85 -60.69 -47.63 85.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.49 -0.323 . . . . 999.99 110.625 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.67 -41.26 96.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.139 0.495 . . . . 799.65 110.552 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -61.89 -47.35 85.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.46 -0.791 . . . . 151.58 110.905 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.5 ttt -59.81 -48.21 82.62 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.429 -0.805 . . . . 168.43 112.82 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -66.04 -31.3 72.1 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.149 0.425 . . . . 530.56 112.149 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.6 m -64.0 -49.72 71.33 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.882 0.372 . . . . 293.49 110.962 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.5 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 76.1 m-70 -72.56 -36.91 68.34 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.235 -0.439 . . . . 383.72 111.636 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -60.13 -45.32 93.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.939 -0.573 . . . . 497.0 111.088 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.76 90.85 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.884 0.327 . . . . 177.0 111.884 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -64.44 -42.22 96.11 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.751 0.31 . . . . 478.76 111.175 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.5 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 38.5 m-85 -70.34 -37.48 74.66 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.245 -0.434 . . . . 727.09 111.371 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.0 ttp -52.29 -46.12 65.79 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.086 -0.506 . . . . 664.46 111.722 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.02 -41.49 98.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.462 -0.335 . . . . 447.74 111.056 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -67.72 -41.59 83.24 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.067 0.46 . . . . 999.99 110.666 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.46 -45.63 97.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 115.637 -0.71 . . . . 398.95 111.223 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -61.86 -40.88 96.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.312 -0.404 . . . . 366.97 111.571 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.77 -42.29 97.82 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.699 0.285 . . . . 709.01 110.747 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.46 -46.16 87.5 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.08 -0.509 . . . . 931.14 111.098 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.64 -46.5 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 CA-C-N 116.196 -0.456 . . . . 175.26 111.111 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.14 -45.3 92.6 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.379 -0.373 . . . . 443.19 111.667 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.56 97.47 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.114 0.413 . . . . 366.44 112.114 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -76.08 -44.36 39.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.865 0.364 . . . . 386.93 111.334 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.46 -10.82 73.27 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.207 -0.521 . . . . 244.67 113.132 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -75.34 155.27 36.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.951 0.405 . . . . 999.99 111.571 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.9 t -93.38 116.95 67.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-N 116.158 -0.473 . . . . 263.29 110.374 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.27 141.9 40.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.322 2.015 . . . . 173.89 113.178 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.45 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 17.9 m -102.45 -176.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 201.66 110.976 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 75.3 t -62.68 -41.03 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.904 0.383 . . . . 81.09 110.112 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.602 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.11 -38.73 94.81 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.795 -0.638 . . . . 106.63 112.39 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -62.02 -40.98 97.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.038 0.447 . . . . 397.23 110.31 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.45 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 48.5 m-85 -69.18 -38.18 78.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.809 -0.632 . . . . 176.41 111.451 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.7 OUTLIER -64.47 -36.12 83.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 121.074 -0.25 . . . . 224.32 110.812 -179.736 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.77 -41.25 92.28 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.027 0.441 . . . . 999.99 110.292 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -66.3 -41.34 89.87 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.733 -0.667 . . . . 158.17 110.388 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.24 -40.07 98.62 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 115.645 -0.707 . . . . 65.71 112.417 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.45 -40.56 94.92 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.484 0.183 . . . . 95.38 111.023 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.13 -40.89 97.15 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.031 0.443 . . . . 381.14 110.659 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.02 -41.5 92.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.75 -0.659 . . . . 182.12 110.658 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -69.29 -10.04 61.96 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.677 -0.692 . . . . 88.8 114.093 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 29.0 mmt85 -78.05 -22.25 49.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.404 0.602 . . . . 999.99 111.299 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -108.42 112.81 25.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.675 0.274 . . . . 999.99 110.314 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.9 mt -126.28 113.54 34.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.108 -0.33 . . . . 308.67 110.108 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -111.62 30.1 7.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.334 -0.394 . . . . 388.05 112.014 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -61.53 -41.33 97.18 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 111.666 0.247 . . . . 360.57 111.666 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.36 94.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.168 0.509 . . . . 184.23 110.989 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -65.31 -35.76 81.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.543 -0.753 . . . . 999.99 111.764 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -58.52 -49.37 77.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.666 0.27 . . . . 374.13 110.987 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -66.09 -38.2 87.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.499 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.37 -41.12 96.57 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.743 0.306 . . . . 558.87 110.349 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.07 -41.32 97.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.114 -0.494 . . . . 332.85 111.132 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.97 -40.9 83.09 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.009 -0.541 . . . . 472.21 111.236 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.18 -39.39 94.52 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.485 -0.325 . . . . 821.44 110.791 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.18 -41.45 83.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.095 -0.502 . . . . 746.24 111.322 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -91.46 1.41 57.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 999.99 111.468 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 58.66 42.21 20.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.058 -0.519 . . . . 675.44 111.512 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 97.7 mmm -102.57 101.82 12.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 999.99 110.795 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.4 mm -94.13 119.81 66.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 390.38 110.794 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.45 153.26 55.34 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.606 2.204 . . . . 243.11 112.434 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -83.91 127.37 33.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.443 -0.344 . . . . 618.1 110.508 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -69.68 122.73 19.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 999.99 111.122 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.9 mt -99.69 117.12 64.17 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 415.25 111.589 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.14 -24.0 38.94 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.423 2.082 . . . . 529.15 112.093 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -65.48 -25.25 67.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.553 -0.749 . . . . 516.88 111.275 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -32.36 49.96 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.018 -0.537 . . . . 914.6 111.953 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.48 -40.12 90.14 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.821 0.343 . . . . 675.31 110.799 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.75 -38.48 89.21 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.94 -0.573 . . . . 900.95 110.872 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.17 -44.95 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.126 -0.488 . . . . 300.73 110.9 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -60.87 -38.4 85.48 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.415 -0.357 . . . . 595.29 111.304 179.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -65.48 -33.07 75.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.28 -0.418 . . . . 999.99 111.154 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 89.7 mmm -70.02 133.58 47.37 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.998 -0.547 . . . . 385.68 111.605 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.478 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.9 mmp_? -53.34 138.41 48.71 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.972 -0.558 . . . . 999.99 111.163 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.84 -38.99 85.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.91 2.406 . . . . 149.6 113.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -65.28 -26.54 68.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.39 -0.368 . . . . 147.02 111.711 179.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -91.68 -3.47 56.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.433 -0.349 . . . . 360.37 111.799 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 125' ' ' ARG . 59.7 t -91.99 114.99 63.8 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.662 0.268 . . . . 187.93 110.543 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.24 147.89 60.77 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.279 1.986 . . . . 265.39 112.344 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.8 m -128.89 153.03 37.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.133 -0.485 . . . . 246.78 110.323 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -128.39 137.28 51.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 999.99 110.979 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -85.21 175.65 8.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.996 -0.547 . . . . 495.41 109.907 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.3 -0.857 . . . . 761.34 110.871 -179.228 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 . . . . . 0 N--CA 1.472 0.667 0 CA-C-O 120.883 0.373 . . . . 999.99 111.634 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.2 p -115.44 4.02 14.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.479 -0.328 . . . . 999.99 111.209 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 3.3 m95 60.92 22.53 12.68 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.018 -0.537 . . . . 999.99 111.862 -179.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.6 m80 58.07 -160.65 0.25 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.946 0.498 . . . . 999.99 111.585 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -110.48 7.16 22.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.598 0.237 . . . . 999.99 111.399 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -119.09 120.88 65.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.821 0.343 . . . . 375.52 111.032 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -87.78 154.62 53.1 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 999.99 110.758 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.05 152.41 72.96 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.544 2.163 . . . . 436.63 112.298 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -82.12 55.61 2.88 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.168 0.433 . . . . 999.99 112.168 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 49.53 64.31 1.81 Allowed 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.43 0.456 . . . . 999.99 111.939 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -55.51 132.38 48.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.08 0.467 . . . . 781.6 111.482 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -73.19 132.53 43.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.688 -0.687 . . . . 216.75 111.372 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.07 -41.94 97.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.058 -0.519 . . . . 902.9 111.044 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.53 -39.16 83.02 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.976 0.417 . . . . 121.35 111.375 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.436 ' CD1' ' HB ' ' A' ' 82' ' ' VAL . 11.9 m-30 -68.45 -34.02 75.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.133 -0.485 . . . . 265.05 109.968 179.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.39 -40.6 93.66 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.615 -0.721 . . . . 524.44 111.761 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.625 HG21 ' HA ' ' A' ' 127' ' ' ALA . 9.8 p -69.79 -36.57 70.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 120.777 -0.369 . . . . 214.56 111.378 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -63.78 -42.05 97.82 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 121.102 0.477 . . . . 61.91 110.477 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.89 -40.86 78.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.603 -0.726 . . . . 321.59 111.01 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 24' ' ' ILE . 40.2 ttpt -59.63 -45.17 92.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.726 -0.67 . . . . 491.97 112.559 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.81 -33.14 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 120.861 -0.336 . . . . 179.68 111.346 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -66.94 -41.52 86.83 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.14 0.495 . . . . 483.12 110.22 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.05 -42.49 88.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.431 -0.804 . . . . 120.91 110.427 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 mm -60.57 -44.12 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 115.754 -0.657 . . . . 324.41 111.268 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.34 97.34 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.53 0.205 . . . . 76.38 111.353 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.37 -41.4 96.54 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 121.005 -0.617 . . . . 59.56 112.675 179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -71.92 -25.55 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.754 0.311 . . . . 169.43 111.335 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.1 t0 -76.91 -36.25 56.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 145.09 110.874 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -60.38 -46.59 89.43 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.845 -0.428 . . . . 779.77 109.845 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.97 -39.27 96.34 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.776 -0.647 . . . . 72.33 112.038 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 60.8 tp -61.64 -40.48 95.06 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 122.659 0.384 . . . . 213.67 111.379 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 28' ' ' ASP . 58.8 t -59.51 -44.26 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.762 -0.199 . . . . 275.82 110.946 -179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.4 -40.78 97.61 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.973 0.416 . . . . 545.0 110.528 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.593 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 72.8 t90 -65.86 -41.66 91.36 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.913 -0.585 . . . . 999.99 109.961 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.424 ' HA ' ' HA3' ' A' ' 39' ' ' GLY . 87.8 mt -61.25 -36.84 81.08 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.64 -0.709 . . . . 205.93 111.468 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.72 -37.77 85.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.551 -0.295 . . . . 557.46 111.296 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.88 -51.16 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 113.53 0.937 . . . . 284.57 113.53 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -109.95 -22.8 11.67 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.174 0.805 . . . . 350.44 113.174 -177.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 35' ' ' LEU . . . -62.38 -21.39 62.18 Favored Glycine 0 N--CA 1.461 0.335 0 C-N-CA 121.145 -0.55 . . . . 199.7 113.828 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -62.84 -18.18 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.079 0.4 . . . . 999.99 112.079 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.0 p -102.81 -6.14 22.88 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.484 0.549 . . . . 302.8 112.484 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.593 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 95.5 mt -73.42 142.77 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.035 0.445 . . . . 581.97 111.719 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.3 m -77.6 161.45 27.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.725 -0.67 . . . . 239.07 110.67 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -41.27 93.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.373 -0.376 . . . . 192.01 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.805 HG13 ' HB2' ' A' ' 114' ' ' TYR . 58.3 t -65.55 -42.74 93.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.157 -0.474 . . . . 278.45 110.721 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.665 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 96.5 mt-30 -63.07 -41.14 99.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.007 -0.542 . . . . 316.42 111.219 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -61.51 -46.69 88.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.262 -0.426 . . . . 470.35 111.353 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.73 -40.17 91.89 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.85 0.357 . . . . 369.78 111.383 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.27 -25.27 68.24 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.046 -0.525 . . . . 66.79 112.214 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 94.0 mt -64.08 -24.37 67.67 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.01 0.744 . . . . 238.3 113.01 -178.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -60.57 -40.71 92.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 526.93 110.338 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -70.65 -37.17 73.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.24 -0.436 . . . . 162.88 110.409 178.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.63 -42.89 97.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.685 -0.689 . . . . 139.01 110.529 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -60.66 -40.13 90.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.94 -0.573 . . . . 198.61 111.173 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -60.87 -46.52 90.29 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.747 0.308 . . . . 999.99 110.414 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.42 -38.74 92.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 799.65 110.706 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.93 -49.01 79.37 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.634 -0.712 . . . . 151.58 111.685 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ptm -67.63 -37.16 82.07 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 121.065 -0.254 . . . . 168.43 111.483 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -65.61 -38.0 88.21 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 111.849 0.314 . . . . 530.56 111.849 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -60.15 -48.17 82.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.72 0.295 . . . . 293.49 111.006 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -71.34 -40.44 70.69 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.794 0.33 . . . . 383.72 111.22 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.9 t-105 -62.6 -45.7 91.68 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.418 0.525 . . . . 497.0 112.418 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.25 84.28 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 112.383 0.512 . . . . 177.0 112.383 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -62.02 -48.7 79.1 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.868 0.366 . . . . 478.76 111.155 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -72.15 -37.39 69.42 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.171 -0.468 . . . . 727.09 112.193 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 67.2 ttp -52.73 -46.79 67.57 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.396 -0.365 . . . . 664.46 111.94 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 67' ' ' LEU . 3.1 mm? -63.06 -44.14 96.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.82 -0.173 . . . . 447.74 111.15 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -63.35 -47.09 83.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.983 0.42 . . . . 999.99 110.628 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.34 -42.91 98.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 115.694 -0.685 . . . . 398.95 110.979 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -59.98 -42.06 93.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.232 -0.44 . . . . 366.97 111.428 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.59 -41.39 98.92 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.938 -0.305 . . . . 709.01 110.532 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.97 -45.45 92.38 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.043 -0.526 . . . . 931.14 110.254 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.45 -44.56 99.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.667 -0.697 . . . . 175.26 110.706 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -61.1 -44.57 97.16 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.111 -0.495 . . . . 443.19 111.138 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.4 97.25 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.426 -0.352 . . . . 366.44 111.409 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.73 -39.65 80.27 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.293 -0.412 . . . . 386.93 111.291 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.43 77.46 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.178 -0.534 . . . . 244.67 112.278 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.95 152.61 38.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 999.99 111.442 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.5 p -117.95 94.48 46.43 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.371 -0.377 . . . . 263.29 110.476 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -72.12 150.27 53.62 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.762 2.308 . . . . 173.89 113.331 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.6 m -101.47 173.08 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.703 -0.68 . . . . 201.66 110.536 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 18' ' ' ALA . 9.0 p -56.33 -26.75 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.631 -0.258 . . . . 81.09 111.643 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.26 -38.66 96.04 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 121.11 -0.567 . . . . 106.63 112.012 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -73.62 -29.07 62.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.037 0.446 . . . . 397.23 110.698 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -69.16 -24.82 64.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.637 -0.71 . . . . 176.41 112.217 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 70.2 p -59.29 -35.83 74.48 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.553 0.216 . . . . 224.32 111.127 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -62.66 -44.9 95.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.034 0.445 . . . . 999.99 110.052 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -65.44 -41.04 93.9 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.705 -0.679 . . . . 158.17 110.492 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.17 98.83 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.598 -0.728 . . . . 65.71 112.652 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.29 -40.14 93.03 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.766 0.317 . . . . 95.38 111.098 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -65.22 -41.19 94.66 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.173 -0.467 . . . . 381.14 110.205 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.52 -42.77 96.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 182.12 110.691 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.62 -36.89 92.51 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.785 -0.643 . . . . 88.8 113.445 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -79.67 -10.87 59.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.196 0.443 . . . . 999.99 112.196 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -108.37 112.47 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 999.99 111.03 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.1 pt -131.85 152.09 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.488 -0.324 . . . . 308.67 111.154 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -155.2 38.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.2 0.524 . . . . 388.05 109.791 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 24.7 ptp -74.77 -16.19 60.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.665 -0.698 . . . . 360.57 112.356 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.15 96.62 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.763 0.316 . . . . 184.23 111.356 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -71.15 -35.19 71.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.355 -0.384 . . . . 999.99 110.971 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.74 -46.68 89.5 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.09 -0.504 . . . . 374.13 110.624 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 45.1 m-85 -63.45 -40.94 98.47 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.623 -0.262 . . . . 999.99 110.975 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -63.52 -40.76 97.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.21 -0.45 . . . . 558.87 110.668 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.32 -41.32 98.91 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.945 -0.57 . . . . 332.85 111.25 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -42.7 99.29 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.253 -0.431 . . . . 472.21 110.786 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -64.0 -42.33 97.21 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.252 -0.431 . . . . 821.44 111.082 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.7 -42.65 84.14 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 746.24 111.791 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -89.41 -3.24 58.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.347 . . . . 999.99 111.396 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.89 42.95 28.27 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.58 0.55 . . . . 675.44 111.447 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mtp -99.74 84.2 2.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.211 -0.449 . . . . 999.99 111.22 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.2 mt -94.43 117.05 67.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 390.38 110.303 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.99 139.96 90.38 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.813 2.342 . . . . 243.11 112.718 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.61 144.88 28.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 618.1 110.66 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.805 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.1 t80 -68.55 108.78 3.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.833 0.349 . . . . 999.99 111.155 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.43 138.57 20.51 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.087 -0.506 . . . . 415.25 110.851 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.03 -33.6 96.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.836 2.357 . . . . 529.15 112.042 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -61.06 -38.78 87.42 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.393 -0.821 . . . . 516.88 111.472 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 64.4 mtt -60.18 -41.78 93.6 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.785 0.326 . . . . 914.6 110.532 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -61.88 -42.55 99.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 675.31 110.622 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.12 -41.08 99.27 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.275 -0.421 . . . . 900.95 110.935 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.94 -44.32 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.142 -0.481 . . . . 300.73 110.796 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -38.33 90.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.349 -0.387 . . . . 595.29 111.704 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.44 -35.11 79.94 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.655 0.613 . . . . 999.99 112.655 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.5 ptp -90.51 149.38 22.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.035 0.445 . . . . 385.68 112.175 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.7 mmp_? -53.51 145.61 27.74 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 115.458 -0.792 . . . . 999.99 111.211 178.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.79 -26.21 81.57 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.948 2.432 . . . . 149.6 112.87 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.625 ' HA ' HG21 ' A' ' 17' ' ' VAL . . . -62.35 -35.98 80.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 147.02 111.695 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.73 -1.08 57.88 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.45 -0.341 . . . . 360.37 111.785 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 94.0 t -81.87 121.99 79.71 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 187.93 110.758 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -68.56 149.1 73.86 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.39 2.06 . . . . 265.39 112.534 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.71 137.95 55.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.9 -0.591 . . . . 246.78 110.052 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -122.35 136.71 54.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 999.99 110.875 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.12 171.3 12.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 495.41 110.45 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.185 -0.912 . . . . 761.34 111.115 -179.274 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 120.783 0.325 . . . . 999.99 110.445 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.8 m -124.25 139.1 54.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 999.99 111.249 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -118.75 147.16 44.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 999.99 110.157 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -85.56 -171.6 3.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.489 . . . . 999.99 111.067 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -67.79 -24.68 65.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.119 -0.491 . . . . 999.99 111.156 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.5 t -99.93 126.6 53.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 375.52 109.904 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 pm0 -79.16 156.74 76.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 999.99 110.959 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -68.37 152.14 75.65 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.425 2.083 . . . . 436.63 112.573 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -109.59 151.24 27.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 999.99 110.399 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -82.14 73.5 9.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 999.99 111.087 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.96 151.38 14.89 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.608 -0.724 . . . . 781.6 111.351 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -61.57 129.05 39.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.354 -0.385 . . . . 216.75 110.582 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.74 -39.94 93.33 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.07 -0.514 . . . . 902.9 111.655 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.03 87.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.013 0.435 . . . . 121.35 111.422 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -70.52 -34.72 72.62 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 265.05 110.222 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -67.01 -41.14 87.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.699 -0.682 . . . . 524.44 112.07 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.787 HG11 ' HA ' ' A' ' 127' ' ' ALA . 30.1 m -73.8 -28.99 25.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 N-CA-C 112.033 0.383 . . . . 214.56 112.033 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.73 93.29 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.222 0.534 . . . . 61.91 109.892 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.11 -36.06 72.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.279 -0.873 . . . . 321.59 111.081 178.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.48 ' O ' HG12 ' A' ' 24' ' ' ILE . 64.4 tttm -59.11 -41.93 89.34 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.641 -0.709 . . . . 491.97 111.712 -178.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.88 -44.6 99.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.584 0.23 . . . . 179.68 110.99 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -64.71 -43.26 94.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.944 0.402 . . . . 483.12 110.955 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.4 -43.92 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 115.795 -0.639 . . . . 120.91 111.59 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 20' ' ' LYS . 29.9 mm -61.06 -41.23 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 116.373 -0.376 . . . . 324.41 111.451 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.03 95.05 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.524 0.194 . . . . 76.38 111.524 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.48 -41.37 98.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.831 -0.699 . . . . 59.56 112.548 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -74.48 -20.1 60.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.633 0.254 . . . . 169.43 111.531 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -76.13 -37.27 58.23 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.969 -0.382 . . . . 145.09 109.969 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -63.3 -40.69 98.06 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.103 -0.703 . . . . 779.77 109.103 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.503 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.81 -37.23 93.96 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.013 -0.994 . . . . 72.33 112.58 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 82.0 mt -58.76 -36.53 74.52 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.164 0.186 . . . . 213.67 111.171 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.32 -41.61 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 116.214 -0.448 . . . . 275.82 111.222 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.52 -42.57 99.01 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.525 0.202 . . . . 545.0 111.381 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.503 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 8.0 m-90 -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.531 0.205 . . . . 999.99 110.992 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.3 mt -62.78 -37.21 85.75 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.93 0.395 . . . . 205.93 110.863 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.94 -37.29 86.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.322 -0.399 . . . . 557.46 111.384 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.66 -51.99 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 113.424 0.898 . . . . 284.57 113.424 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.93 -21.26 12.73 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.967 0.728 . . . . 350.44 112.967 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.641 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.73 -37.9 93.08 Favored Glycine 0 N--CA 1.46 0.25 0 C-N-CA 121.233 -0.508 . . . . 199.7 113.325 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -61.71 -20.46 63.52 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.988 0.366 . . . . 999.99 111.988 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.3 p -105.63 -4.36 21.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.983 0.364 . . . . 302.8 111.983 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.641 HD12 ' HA2' ' A' ' 39' ' ' GLY . 91.0 mt -72.92 146.28 46.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.084 0.469 . . . . 581.97 111.63 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.0 m -76.82 164.55 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.808 -0.633 . . . . 239.07 110.582 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.6 m -59.67 -41.95 91.78 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.346 -0.388 . . . . 192.01 111.072 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 114' ' ' TYR . 69.5 t -65.87 -42.47 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.26 -0.427 . . . . 278.45 110.482 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -63.28 -40.59 97.81 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.125 -0.488 . . . . 316.42 111.16 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -61.38 -46.66 89.27 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.271 -0.422 . . . . 470.35 110.784 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.58 -39.71 91.94 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.303 -0.408 . . . . 369.78 111.177 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.27 83.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.722 -0.672 . . . . 66.79 111.907 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.6 -32.08 49.64 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.77 0.656 . . . . 238.3 112.77 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -62.93 -42.88 99.94 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.801 0.334 . . . . 526.93 110.751 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -70.99 -39.27 72.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.196 0.522 . . . . 162.88 109.813 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -60.5 -41.42 87.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.252 -0.885 . . . . 139.01 111.191 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -58.68 -45.19 89.97 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.501 0.191 . . . . 198.61 110.921 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -65.07 -41.59 94.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.747 0.308 . . . . 999.99 110.747 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -63.9 -40.84 97.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.266 0.555 . . . . 799.65 110.253 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -58.96 -48.51 81.27 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.282 -0.872 . . . . 151.58 110.376 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -45.7 92.03 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.729 -0.669 . . . . 168.43 111.49 179.235 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.54 -39.65 94.29 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.264 -0.425 . . . . 530.56 111.689 -179.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.5 m -61.09 -47.06 88.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.985 0.421 . . . . 293.49 110.776 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.49 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 67.7 m80 -70.12 -38.71 75.65 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.088 -0.505 . . . . 383.72 111.346 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -60.29 -48.16 82.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.301 -0.409 . . . . 497.0 111.02 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.64 94.19 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 111.843 0.312 . . . . 177.0 111.843 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.85 -48.45 78.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.426 -0.352 . . . . 478.76 111.727 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.49 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 62.7 m-85 -71.06 -36.38 72.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.524 -0.307 . . . . 727.09 111.79 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 62.4 ttp -52.42 -44.89 65.67 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.381 0.425 . . . . 664.46 112.062 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.8 mt -61.45 -42.23 98.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.479 0.18 . . . . 447.74 111.16 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -68.84 -40.39 79.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 999.99 110.593 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 88' ' ' LEU . 95.1 mt -63.65 -44.84 98.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.761 -0.654 . . . . 398.95 110.883 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.69 -39.43 88.46 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.282 -0.417 . . . . 366.97 111.567 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.28 -48.19 82.8 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.857 0.361 . . . . 709.01 110.496 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.7 tptm -64.79 -45.11 87.68 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.858 -0.61 . . . . 931.14 111.092 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 37.4 mm -62.96 -45.8 97.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.028 -0.533 . . . . 175.26 111.948 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -61.6 -40.46 94.9 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.745 -0.207 . . . . 443.19 110.997 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.5 95.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.345 . . . . 366.44 111.135 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.9 mt -70.06 -39.94 75.36 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.189 -0.46 . . . . 386.93 111.425 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.9 -8.82 79.26 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 121.107 -0.568 . . . . 244.67 112.411 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -74.73 152.07 39.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.622 0.249 . . . . 999.99 111.318 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -115.2 94.36 38.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.51 -0.314 . . . . 263.29 110.987 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.34 143.23 97.78 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.323 2.682 . . . . 173.89 113.446 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.429 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 16.2 m -100.76 -177.82 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.842 -0.617 . . . . 201.66 110.607 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.1 t -58.13 -42.48 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-N 116.421 -0.354 . . . . 81.09 110.88 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -39.47 96.83 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.28 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.21 -38.52 91.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 397.23 111.428 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 39.3 m-85 -67.91 -26.4 65.97 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.749 0.648 . . . . 176.41 112.749 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -57.14 -34.66 68.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 121.004 -0.278 . . . . 224.32 111.218 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -65.53 -41.11 93.43 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.954 0.407 . . . . 999.99 110.484 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 69' ' ' ILE . 86.8 mt -66.93 -40.96 87.75 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.796 -0.638 . . . . 158.17 110.493 179.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.74 -40.73 99.57 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.626 -0.715 . . . . 65.71 112.178 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.96 -39.77 93.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.636 0.255 . . . . 95.38 110.933 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.05 -40.48 94.8 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.254 -0.43 . . . . 381.14 110.595 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.93 -42.57 96.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.897 -0.592 . . . . 182.12 110.348 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -65.05 -17.33 63.27 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.787 -0.642 . . . . 88.8 113.437 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -80.09 -13.03 59.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.987 0.394 . . . . 999.99 111.178 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -107.48 112.1 24.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 999.99 110.282 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 78.2 mt -125.4 125.95 69.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.292 -0.413 . . . . 308.67 110.746 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -130.6 48.53 2.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.077 0.465 . . . . 388.05 110.516 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 67.2 mtt -66.77 -35.54 80.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.654 -0.703 . . . . 360.57 111.661 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.4 -38.12 79.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.32 -0.4 . . . . 184.23 111.33 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -59.27 -47.13 86.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.272 -0.422 . . . . 999.99 110.397 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -58.62 -48.26 81.59 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.106 -0.497 . . . . 374.13 111.249 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 58.1 m-85 -62.81 -41.63 99.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.768 0.318 . . . . 999.99 110.985 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -64.23 -43.6 94.45 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.076 -0.511 . . . . 558.87 111.224 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.77 -41.36 97.6 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.154 -0.475 . . . . 332.85 111.721 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.91 -48.48 76.43 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.465 -0.334 . . . . 472.21 111.08 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.94 -40.21 95.91 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.678 0.275 . . . . 821.44 111.283 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.62 -44.67 90.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.19 -0.459 . . . . 746.24 111.959 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -86.53 -11.26 52.13 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.897 0.332 . . . . 999.99 111.897 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.07 39.94 31.73 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.397 0.435 . . . . 675.44 111.778 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mmm -109.68 108.8 19.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.871 0.367 . . . . 999.99 111.483 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.46 120.02 65.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 390.38 110.126 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.61 146.14 54.12 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.279 1.986 . . . . 243.11 112.754 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -84.94 142.26 29.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 618.1 110.692 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.51 ' HB2' HG13 ' A' ' 45' ' ' VAL . 78.2 t80 -69.34 109.6 4.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.401 -0.363 . . . . 999.99 110.969 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.59 126.02 40.64 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.437 -0.347 . . . . 415.25 111.011 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -56.91 -32.63 93.05 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.042 2.495 . . . . 529.15 112.355 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -59.74 -45.28 92.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.758 -0.655 . . . . 516.88 111.642 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 77.9 mtm -60.16 -40.89 91.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.695 0.283 . . . . 914.6 110.253 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 55.2 tp10 -60.79 -43.0 98.68 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.976 -0.557 . . . . 675.31 110.104 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.505 ' O ' ' HG2' ' A' ' 124' ' ' MET . 88.9 tt0 -61.62 -44.74 96.43 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.813 -0.63 . . . . 900.95 110.973 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.8 mm -61.53 -43.74 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 CA-C-N 116.419 -0.355 . . . . 300.73 111.392 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -61.8 -38.66 88.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.624 0.25 . . . . 595.29 111.474 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -66.44 -32.66 74.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.338 -0.392 . . . . 999.99 111.771 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 120' ' ' GLU . 26.5 mmt -70.43 141.31 52.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.503 -0.317 . . . . 385.68 111.416 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.499 ' O ' HG23 ' A' ' 129' ' ' VAL . 95.7 mtm-85 -52.26 139.46 35.98 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 115.776 -0.647 . . . . 999.99 111.044 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -60.44 -25.97 81.7 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.734 2.289 . . . . 149.6 112.794 -179.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.787 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -62.22 -36.7 82.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 147.02 111.43 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -92.12 -0.09 57.45 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.191 0.441 . . . . 360.37 112.191 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.0 t -89.59 117.55 68.25 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.692 0.282 . . . . 187.93 111.305 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -72.83 160.85 45.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.814 2.343 . . . . 265.39 112.388 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 92.3 t -106.18 137.19 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.936 0.398 . . . . 246.78 110.444 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -96.4 126.94 41.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 999.99 110.891 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -82.76 149.66 27.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 495.41 110.15 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.3 mmt . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.471 -0.776 . . . . 761.34 110.767 -179.718 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.9 mtt85 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 113.715 1.006 . . . . 999.99 113.715 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.1 m -130.66 141.8 50.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.768 -0.196 . . . . 999.99 110.827 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 9.0 t-105 -157.51 142.29 16.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 999.99 110.393 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.05 -39.26 93.03 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.697 0.628 . . . . 999.99 112.697 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -87.05 -90.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.159 0.429 . . . . 999.99 112.159 -178.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.0 122.84 70.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 375.52 111.037 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.29 126.49 60.36 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.967 -0.561 . . . . 999.99 110.704 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.656 ' HB3' HD12 ' A' ' 11' ' ' LEU . 59.9 Cg_exo -56.55 134.66 65.79 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.712 2.275 . . . . 436.63 112.2 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -125.59 -47.07 1.71 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.465 -0.334 . . . . 999.99 111.838 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -105.28 -7.79 18.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.327 0.491 . . . . 999.99 112.327 -178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.656 HD12 ' HB3' ' A' ' 8' ' ' PRO . 92.0 mt -58.81 138.99 56.93 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.886 0.374 . . . . 781.6 111.573 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -100.3 118.51 36.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 216.75 110.179 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -61.6 -38.94 89.43 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.003 -0.544 . . . . 902.9 111.643 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.03 87.29 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.856 0.36 . . . . 121.35 111.396 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -70.07 -30.72 68.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 265.05 110.03 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -64.38 -39.05 93.11 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.746 -0.661 . . . . 524.44 109.526 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.31 -44.88 96.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.51 -0.768 . . . . 214.56 111.017 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 21' ' ' VAL . . . -61.89 -38.77 89.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.151 0.501 . . . . 61.91 110.397 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.6 -39.61 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.759 -0.655 . . . . 321.59 111.085 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 24' ' ' ILE . 98.1 mttt -60.23 -41.24 92.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.81 0.671 . . . . 491.97 112.81 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 18' ' ' ALA . 9.9 p -66.03 -36.36 77.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 120.719 -0.393 . . . . 179.68 111.208 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.432 ' OE1' ' HA ' ' A' ' 86' ' ' THR . 63.1 tt0 -67.02 -39.98 87.15 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.101 0.477 . . . . 483.12 110.249 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.89 -43.52 98.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 115.544 -0.753 . . . . 120.91 110.436 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 20' ' ' LYS . 31.8 mm -60.09 -43.91 93.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-N 115.511 -0.768 . . . . 324.41 111.775 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.96 95.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.013 0.375 . . . . 76.38 112.013 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.3 -42.83 95.95 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.731 -0.747 . . . . 59.56 113.103 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HE1' HG22 ' A' ' 92' ' ' ILE . 38.0 m-85 -74.69 -19.81 60.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.056 0.391 . . . . 169.43 112.056 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.427 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.7 t0 -76.42 -39.48 53.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.738 -0.21 . . . . 145.09 111.182 -178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -62.55 -43.33 99.08 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.947 0.403 . . . . 779.77 109.944 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.31 -39.58 94.37 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.691 -0.686 . . . . 72.33 112.225 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -63.24 -42.56 99.24 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 122.33 0.252 . . . . 213.67 111.209 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 28' ' ' ASP . 63.0 t -60.94 -46.03 97.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.567 -0.288 . . . . 275.82 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -63.17 -41.25 99.2 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.848 0.356 . . . . 545.0 110.636 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -63.92 -44.13 93.83 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.337 0.589 . . . . 999.99 109.978 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.461 HD21 ' HE3' ' A' ' 47' ' ' LYS . 61.7 tp -60.77 -39.07 87.43 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.104 -0.953 . . . . 205.93 111.42 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -64.4 -25.01 67.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.907 0.336 . . . . 557.46 111.907 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.3 t -86.81 -51.06 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 N-CA-C 113.128 0.788 . . . . 284.57 113.128 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.653 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.1 m-70 -98.98 -4.03 33.56 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.737 0.643 . . . . 350.44 112.737 -178.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.49 -34.9 70.16 Favored Glycine 0 N--CA 1.46 0.289 0 CA-C-N 116.169 -0.468 . . . . 199.7 114.086 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -62.26 -19.91 63.71 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.098 0.407 . . . . 999.99 112.098 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.492 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.2 p -111.69 -13.06 13.8 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.792 0.664 . . . . 302.8 112.792 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 95.1 mt -72.96 137.27 45.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.804 0.335 . . . . 581.97 111.815 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.5 p -78.04 165.47 23.98 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.305 -0.407 . . . . 239.07 110.359 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.8 m -61.76 -44.15 97.45 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.771 0.319 . . . . 192.01 111.188 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.627 HG13 ' HB2' ' A' ' 114' ' ' TYR . 70.6 t -66.91 -43.69 89.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.219 -0.446 . . . . 278.45 111.035 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 64.9 tt0 -63.11 -40.78 98.62 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.453 . . . . 316.42 111.12 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HE3' HD21 ' A' ' 35' ' ' LEU . 87.8 tttt -60.36 -47.12 87.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.311 -0.404 . . . . 470.35 111.241 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.88 -40.38 95.02 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.906 0.384 . . . . 369.78 110.914 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.68 86.13 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.711 -0.677 . . . . 66.79 111.647 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 83.9 mt -60.61 -35.63 76.61 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.899 0.703 . . . . 238.3 112.899 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -59.67 -41.24 90.16 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.969 -0.382 . . . . 526.93 109.969 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -68.69 -39.41 80.53 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.217 -0.447 . . . . 162.88 109.898 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.446 HG11 ' CE2' ' A' ' 101' ' ' PHE . 57.4 t -60.32 -41.29 86.64 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 CA-C-N 115.877 -0.601 . . . . 139.01 110.442 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -59.11 -42.43 90.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.427 -0.351 . . . . 198.61 110.394 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.655 ' O ' ' HG2' ' A' ' 58' ' ' MET . 98.7 mtt180 -64.77 -42.54 95.04 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.18 -0.464 . . . . 999.99 110.439 178.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -65.31 -42.71 92.72 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.496 0.665 . . . . 799.65 110.633 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -60.59 -47.02 88.05 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.96 -1.018 . . . . 151.58 111.865 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 55' ' ' ARG . 14.0 ptt? -58.98 -39.27 81.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.745 0.307 . . . . 168.43 110.852 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.453 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 29.5 mm100 -69.63 -39.05 77.39 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.189 -0.46 . . . . 530.56 111.2 179.055 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.7 m -61.44 -48.01 83.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.288 -0.414 . . . . 293.49 110.959 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.6 -48.53 79.0 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.083 -0.508 . . . . 383.72 110.827 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.4 t-105 -64.85 -40.24 94.84 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.912 0.708 . . . . 497.0 112.912 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.93 -37.9 72.13 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.915 0.709 . . . . 177.0 112.915 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.68 -46.97 87.46 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.674 0.273 . . . . 478.76 110.977 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -77.83 -41.1 38.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.418 -0.355 . . . . 727.09 111.127 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.6 ttt -53.6 -45.02 69.88 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.013 0.745 . . . . 664.46 113.013 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.2 tp -57.81 -45.46 86.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.014 0.375 . . . . 447.74 112.014 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -65.56 -40.87 93.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 999.99 111.172 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mm -70.63 -42.97 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.115 -0.493 . . . . 398.95 111.082 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -60.66 -38.9 86.41 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.805 -0.634 . . . . 366.97 111.925 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.22 -46.33 88.76 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 110.261 -0.274 . . . . 709.01 110.261 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.79 -41.28 92.18 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.357 -0.383 . . . . 931.14 111.071 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.05 -45.69 98.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.381 -0.372 . . . . 175.26 110.998 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.85 -43.1 99.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.175 -0.466 . . . . 443.19 111.124 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.51 -40.26 96.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.348 -0.387 . . . . 366.44 111.09 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.58 -38.54 80.78 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.169 -0.469 . . . . 386.93 111.343 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.7 5.02 75.16 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.952 -0.642 . . . . 244.67 112.48 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -74.18 147.56 42.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.867 0.365 . . . . 999.99 111.269 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -102.9 109.39 61.23 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 263.29 110.812 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -59.43 138.44 84.17 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.746 2.297 . . . . 173.89 112.549 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.9 m -102.37 172.61 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.447 . . . . 201.66 111.692 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.3 t -61.16 -41.13 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 115.68 -0.691 . . . . 81.09 110.97 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.02 -41.88 98.14 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.782 -0.723 . . . . 106.63 112.398 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.84 -40.13 94.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.128 0.489 . . . . 397.23 110.216 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -66.63 -39.88 88.48 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.517 -0.765 . . . . 176.41 111.591 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.9 OUTLIER -64.22 -34.33 77.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.988 -0.285 . . . . 224.32 111.025 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.73 -40.99 92.74 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.212 0.529 . . . . 999.99 109.593 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.98 -38.61 86.38 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.327 -0.851 . . . . 158.17 110.476 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.99 -39.18 95.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.621 -0.718 . . . . 65.71 113.067 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.7 97.12 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.895 0.379 . . . . 95.38 110.2 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.4 -40.39 89.58 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.839 -0.619 . . . . 381.14 110.363 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.437 HG22 ' HE1' ' A' ' 27' ' ' PHE . 97.3 mt -61.61 -45.6 98.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.729 -0.669 . . . . 182.12 111.321 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -81.9 -2.56 90.59 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.937 -0.649 . . . . 88.8 113.64 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -79.45 -30.67 42.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.123 0.461 . . . . 999.99 110.953 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -108.63 112.65 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.512 -0.313 . . . . 999.99 110.937 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.7 mm -124.89 125.55 69.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.585 -0.524 . . . . 308.67 109.585 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -141.76 68.97 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.894 0.378 . . . . 388.05 111.582 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.3 mmm -70.97 -28.21 64.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.86 -0.609 . . . . 360.57 111.192 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.21 -38.16 82.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.66 -0.7 . . . . 184.23 112.031 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -59.24 -48.8 80.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.4 -0.363 . . . . 999.99 111.135 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.446 ' CE2' HG11 ' A' ' 53' ' ' VAL . 83.3 t80 -60.01 -46.81 88.26 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.585 -0.279 . . . . 374.13 110.962 179.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -58.44 -47.44 83.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.037 -0.529 . . . . 999.99 111.141 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.7 -46.08 91.75 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.578 -0.283 . . . . 558.87 110.804 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.16 98.08 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.256 -0.429 . . . . 332.85 111.378 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.49 -45.23 93.96 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.981 -0.554 . . . . 472.21 110.956 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -62.75 -39.31 93.71 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.243 -0.435 . . . . 821.44 110.782 179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.13 -40.95 82.61 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.962 -0.563 . . . . 746.24 111.39 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -83.41 -11.73 57.25 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.316 -0.402 . . . . 999.99 111.518 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.5 t30 54.06 45.99 26.39 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 122.96 0.504 . . . . 675.44 111.781 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.4 mtp -107.91 113.85 27.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.881 0.372 . . . . 999.99 111.361 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.8 mt -94.33 118.73 67.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 390.38 110.185 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.66 139.51 34.11 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.307 2.005 . . . . 243.11 112.97 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -86.07 141.27 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 618.1 110.692 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.627 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.8 t80 -68.66 119.93 13.86 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.714 0.292 . . . . 999.99 110.615 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -98.59 123.83 48.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.47 -0.332 . . . . 415.25 111.322 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -57.83 -31.74 93.19 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.953 2.435 . . . . 529.15 112.449 178.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -61.24 -28.17 68.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.696 -0.684 . . . . 516.88 111.702 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.06 -37.66 80.53 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.337 -0.392 . . . . 914.6 111.093 -179.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.58 -40.32 91.28 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 675.31 110.933 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.27 -40.55 96.22 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.475 -0.329 . . . . 900.95 110.978 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.2 mm -61.43 -45.72 98.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.152 -0.477 . . . . 300.73 110.673 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -39.1 93.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.817 -0.628 . . . . 595.29 111.995 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 54.8 mmm-85 -67.72 -34.25 76.49 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.973 0.731 . . . . 999.99 112.973 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.2 ptp -81.3 151.02 28.25 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.129 0.49 . . . . 385.68 112.252 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -51.75 134.52 36.54 Favored Pre-proline 0 N--CA 1.466 0.353 0 CA-C-N 115.285 -0.87 . . . . 999.99 111.457 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -53.12 -32.59 59.94 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.303 2.668 . . . . 149.6 113.171 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.07 -36.25 76.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 147.02 111.663 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -91.87 8.14 38.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.453 -0.34 . . . . 360.37 111.736 -179.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 72.8 t -91.43 114.78 62.87 Favored Pre-proline 0 C--O 1.234 0.244 0 CA-C-O 120.818 0.342 . . . . 187.93 110.965 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.46 157.59 49.02 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.676 2.251 . . . . 265.39 112.772 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.453 ' HB ' ' HG3' ' A' ' 59' ' ' GLN . 16.7 m -126.84 158.82 37.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.074 -0.512 . . . . 246.78 110.593 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -113.98 128.94 56.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.881 0.372 . . . . 999.99 111.297 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -83.17 161.62 21.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.928 -0.578 . . . . 495.41 109.985 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.173 -0.918 . . . . 761.34 110.687 -179.411 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 C--O 1.232 0.159 0 N-CA-C 110.031 -0.359 . . . . 375.51999999999998 110.031 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -91.11 116.1 65.74 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.682 -0.236 . . . . 999.99000000000001 110.418 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' OD1' ' A' ' 74' ' ' ASP . 59.9 Cg_endo -72.4 140.2 33.04 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.135 . . . . 436.63 112.783 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -99.68 -12.7 19.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 999.99000000000001 111.17 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -107.98 10.79 28.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 999.99000000000001 111.087 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.05 124.62 19.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.856 -0.611 . . . . 781.60000000000002 111.909 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.522 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.5 t-20 -109.98 110.34 21.23 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.311 -0.626 . . . . 216.75 109.311 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.08 -39.34 92.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.294 0.479 . . . . 902.89999999999998 112.294 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.83 -41.21 90.83 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.95 0.352 . . . . 121.34999999999999 111.95 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -72.56 -27.71 62.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.411 -0.358 . . . . 265.05000000000001 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 12' ' ' ASN . 78.2 mm-40 -63.97 -40.04 95.51 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.104 -0.498 . . . . 524.44000000000005 112.115 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 14' ' ' ALA . 9.3 p -67.27 -36.07 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 120.757 -0.377 . . . . 214.56 110.938 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.84 -42.61 99.81 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.195 0.521 . . . . 61.909999999999997 109.98 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.6 tp -66.08 -42.68 89.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.23 -0.895 . . . . 321.58999999999997 110.758 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.16 -41.75 93.45 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.588 -0.733 . . . . 491.97000000000003 111.603 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' VAL . 65.7 t -63.15 -43.09 98.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 116.61 -0.268 . . . . 179.68000000000001 111.067 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.08 -40.97 97.41 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.884 0.374 . . . . 483.12 110.564 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.58 -43.92 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 115.829 -0.623 . . . . 120.91 111.025 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.3 mt -61.02 -44.16 97.64 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 116.124 -0.489 . . . . 324.41000000000003 111.388 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.13 -43.52 95.63 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.58 0.229 . . . . 76.379999999999995 111.222 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.78 -39.39 96.59 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 121.146 -0.549 . . . . 59.560000000000002 112.435 178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -72.38 -20.59 61.42 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.6 0.36 . . . . 169.43000000000001 111.718 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -78.1 -23.57 47.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.183 -0.207 . . . . 145.09 111.535 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' VAL . 95.6 mtt-85 -65.48 -42.48 92.17 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.089 0.471 . . . . 779.76999999999998 110.026 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -25.14 73.58 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.722 -0.672 . . . . 72.329999999999998 112.636 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.0 tp -63.09 -44.68 95.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.592 0.234 . . . . 213.66999999999999 111.248 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.565 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.0 p -66.41 -31.73 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.462 -0.335 . . . . 275.81999999999999 111.137 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.51 -40.58 95.9 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.971 0.415 . . . . 545.0 110.258 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.3 t90 -67.07 -38.94 86.66 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.706 -0.679 . . . . 999.99000000000001 109.292 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 32' ' ' VAL . 92.5 mt -61.37 -36.34 79.97 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.029 -0.987 . . . . 205.93000000000001 111.298 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -65.5 -21.27 66.61 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.058 0.392 . . . . 557.46000000000004 112.058 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 63.6 t -86.43 -47.59 16.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 112.521 0.563 . . . . 284.56999999999999 112.521 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.14 17.23 21.84 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.279 0.474 . . . . 350.44 112.279 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.81 -39.29 96.6 Favored Glycine 0 CA--C 1.518 0.239 0 N-CA-C 114.446 0.538 . . . . 199.69999999999999 114.446 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.2 ptt180 -63.27 -26.32 68.72 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.492 0.553 . . . . 999.99000000000001 112.492 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.543 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.1 p -113.15 8.11 18.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.96 0.356 . . . . 302.80000000000001 111.96 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.4 tp -72.39 121.98 20.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.805 0.336 . . . . 581.97000000000003 111.535 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.6 p -80.78 169.24 17.84 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.385 -0.371 . . . . 239.06999999999999 110.258 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.3 m -62.38 -43.96 97.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.741 0.305 . . . . 192.00999999999999 111.209 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -28.42 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 278.44999999999999 112.539 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 15.0 mm100 -62.71 -39.45 94.08 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.42 0.155 . . . . 316.42000000000002 111.42 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -60.57 -46.84 88.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.86 0.362 . . . . 470.35000000000002 110.202 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.91 -38.6 86.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.872 -0.604 . . . . 369.77999999999997 110.794 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.01 81.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.662 -0.699 . . . . 66.790000000000006 111.496 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.4 mt -60.88 -36.41 79.12 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.158 -0.474 . . . . 238.30000000000001 111.796 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -61.07 -39.49 90.1 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.372 -0.603 . . . . 526.92999999999995 109.372 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -65.97 -40.94 91.71 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.619 -0.719 . . . . 162.88 109.603 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.42 HG13 ' CE2' ' A' ' 101' ' ' PHE . 55.3 t -61.57 -41.97 92.28 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 115.729 -0.669 . . . . 139.00999999999999 110.448 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -59.49 -41.65 90.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.927 -0.579 . . . . 198.61000000000001 110.821 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.2 -41.95 96.84 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.068 -0.253 . . . . 999.99000000000001 110.619 178.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -64.79 -40.23 94.9 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.29 0.567 . . . . 799.64999999999998 109.982 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -60.42 -46.62 89.37 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.083 -0.962 . . . . 151.58000000000001 110.234 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ttt -59.11 -43.65 91.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.772 -0.649 . . . . 168.43000000000001 110.795 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -62.72 -42.61 99.74 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.799 0.333 . . . . 530.55999999999995 110.993 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.1 m -68.32 -42.89 78.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.22 0.533 . . . . 293.49000000000001 110.861 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.419 ' NE2' ' HE1' ' A' ' 65' ' ' TYR . 71.7 t60 -63.27 -38.74 92.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.512 -0.767 . . . . 383.72000000000003 110.759 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -55.95 -32.66 64.04 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.893 -0.594 . . . . 497.0 112.553 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.74 -38.68 78.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 177.0 111.681 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -43.46 97.45 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.897 0.379 . . . . 478.75999999999999 111.73 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.419 ' HE1' ' NE2' ' A' ' 61' ' ' HIS . 76.8 m-85 -84.74 -20.45 31.07 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.706 0.632 . . . . 727.09000000000003 112.706 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.7 ttt -50.92 -50.19 58.16 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.568 0.581 . . . . 664.46000000000004 112.568 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 87.3 mt -64.6 -41.9 95.92 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 111.9 0.333 . . . . 447.74000000000001 111.9 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -71.26 -52.76 17.15 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.398 0.888 . . . . 999.99000000000001 113.398 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.1 mt -84.85 -60.09 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 114.752 1.39 . . . . 398.94999999999999 114.752 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.23 -42.19 99.21 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.373 1.249 . . . . 366.97000000000003 114.373 -175.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 40.2 ttpt -62.22 -45.91 91.24 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.739 -0.384 . . . . 709.00999999999999 111.297 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -65.13 -42.43 93.86 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.92 0.341 . . . . 931.13999999999999 111.92 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.2 mt -62.88 -46.78 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.628 0.251 . . . . 175.25999999999999 111.203 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 36.6 t70 -63.0 -45.6 91.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.355 -0.384 . . . . 443.19 111.468 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.01 -40.63 96.78 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.069 0.396 . . . . 366.44 112.069 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.14 -39.18 79.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.319 . . . . 386.93000000000001 111.522 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.03 -3.47 84.55 Favored Glycine 0 CA--C 1.518 0.27 0 C-N-CA 120.844 -0.693 . . . . 244.66999999999999 112.311 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -74.15 149.87 40.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.826 0.346 . . . . 999.99000000000001 111.036 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.0 p -112.63 95.31 32.03 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.338 -0.392 . . . . 263.29000000000002 111.059 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.86 146.08 98.06 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.061 2.507 . . . . 173.88999999999999 112.463 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.92 -179.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.232 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.69 -42.33 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.28 -0.418 . . . . 81.090000000000003 111.157 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.563 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.58 -40.45 97.87 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.682 -0.771 . . . . 106.63 112.143 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.81 -40.95 96.05 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.902 0.382 . . . . 397.23000000000002 110.718 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -68.55 -37.69 80.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.868 -0.605 . . . . 176.41 112.278 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -61.48 -35.15 76.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.917 -0.313 . . . . 224.31999999999999 111.077 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.2 mmm180 -66.75 -40.65 88.39 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.171 0.51 . . . . 999.99000000000001 110.092 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.46 -38.89 88.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.499 -0.773 . . . . 158.16999999999999 110.585 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.65 -39.04 96.01 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.536 -0.756 . . . . 65.709999999999994 112.615 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.07 96.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.617 0.246 . . . . 95.379999999999995 110.802 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -66.25 -41.67 89.66 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.98 0.419 . . . . 381.13999999999999 110.335 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.01 -43.41 97.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.931 -0.577 . . . . 182.12 110.796 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -79.08 -2.05 86.42 Favored Glycine 0 CA--C 1.519 0.342 0 CA-C-N 116.022 -0.535 . . . . 88.799999999999997 113.43 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -77.38 -31.34 54.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 999.99000000000001 110.709 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -103.48 112.55 25.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 999.99000000000001 110.152 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.5 mt -128.18 124.01 61.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.367 -0.379 . . . . 308.67000000000002 110.059 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -140.46 70.96 1.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.887 0.375 . . . . 388.05000000000001 111.097 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 61.8 mtt -70.31 -28.17 64.96 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.969 -0.559 . . . . 360.56999999999999 111.19 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.24 82.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.918 -0.583 . . . . 184.22999999999999 111.285 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -59.52 -47.82 84.03 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.241 -0.436 . . . . 999.99000000000001 110.83 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.42 ' CE2' HG13 ' A' ' 53' ' ' VAL . 43.4 t80 -60.29 -47.76 84.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.345 -0.389 . . . . 374.13 110.304 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -59.83 -47.87 83.96 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.765 -0.652 . . . . 999.99000000000001 111.154 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -60.84 -46.7 89.53 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.41 -0.359 . . . . 558.87 111.255 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.83 98.69 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.459 -0.337 . . . . 332.85000000000002 111.388 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.25 -44.27 92.29 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.077 -0.51 . . . . 472.20999999999998 110.783 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -63.68 -41.91 98.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.673 -0.694 . . . . 821.44000000000005 110.952 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.83 -42.83 85.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.09 -0.504 . . . . 746.24000000000001 112.171 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -88.43 -7.9 55.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.173 -0.211 . . . . 999.99000000000001 111.493 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.04 39.04 31.43 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.081 0.771 . . . . 675.44000000000005 113.081 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.15 61.26 1.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.882 0.373 . . . . 999.99000000000001 110.743 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.0 mt -82.13 121.7 79.01 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.222 -0.445 . . . . 390.38 110.699 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.94 152.73 63.44 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.563 2.176 . . . . 243.11000000000001 112.548 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -74.79 136.3 41.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 618.10000000000002 110.767 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -69.58 90.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 999.99000000000001 110.963 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.16 145.36 29.87 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.009 -0.541 . . . . 415.25 111.564 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.06 -30.28 47.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.555 2.17 . . . . 529.14999999999998 112.35 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -63.29 -45.48 91.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.102 -0.499 . . . . 516.88 110.185 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 98.1 mtp -62.36 -40.24 95.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.927 -0.579 . . . . 914.60000000000002 110.164 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.26 -41.6 97.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.535 -0.757 . . . . 675.30999999999995 110.535 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.22 -39.42 93.93 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.838 -0.619 . . . . 900.95000000000005 110.883 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 90.0 mt -61.51 -44.0 97.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 116.086 -0.506 . . . . 300.73000000000002 110.872 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.08 -36.38 83.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 595.28999999999996 111.147 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -70.54 -16.12 62.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 999.99000000000001 112.229 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 75.1 mtm -69.93 140.07 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.973 -0.291 . . . . 385.68000000000001 110.811 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 129' ' ' VAL . 59.6 ttp180 -51.41 129.82 33.57 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.857 -0.611 . . . . 999.99000000000001 111.367 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -53.15 -34.74 70.18 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.383 2.722 . . . . 149.59999999999999 113.326 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.51 76.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 147.02000000000001 111.838 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -91.11 0.48 57.53 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.946 0.35 . . . . 360.37 111.946 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 125' ' ' ARG . 58.4 t -98.19 111.11 58.72 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.715 0.293 . . . . 187.93000000000001 111.138 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.39 151.03 82.24 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.084 2.523 . . . . 265.38999999999999 112.301 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.98 142.72 32.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.984 0.421 . . . . 246.78 110.704 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -132.78 148.14 52.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.91 -0.586 . . . . 999.99000000000001 110.557 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -83.99 173.92 10.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 495.41000000000003 110.349 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.237 -0.887 . . . . 761.34000000000003 110.921 -178.94 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.437 -0.209 . . . . 375.51999999999998 110.437 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.76 129.25 65.9 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.599 -0.273 . . . . 999.99000000000001 110.311 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.73 130.03 15.28 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.315 2.01 . . . . 436.63 113.258 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -124.84 1.69 8.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 999.99000000000001 110.918 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -104.73 8.93 35.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.376 . . . . 999.99000000000001 111.81 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.3 mt -56.78 113.7 1.76 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.893 0.378 . . . . 781.60000000000002 111.767 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -114.37 115.01 26.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.722 -0.473 . . . . 216.75 109.722 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -61.7 -39.76 92.59 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.474 -0.33 . . . . 902.89999999999998 111.74 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -40.41 89.34 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.968 0.413 . . . . 121.34999999999999 111.644 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -71.35 -31.39 67.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.095 -0.502 . . . . 265.05000000000001 110.492 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -65.14 -41.19 95.03 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.824 -0.626 . . . . 524.44000000000005 112.016 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.749 HG11 ' HA ' ' A' ' 127' ' ' ALA . 18.7 m -73.99 -29.83 26.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.731 -0.388 . . . . 214.56 111.455 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.92 -40.04 95.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.561 0.696 . . . . 61.909999999999997 109.262 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HA3' ' A' ' 89' ' ' GLY . 61.2 tp -64.64 -39.64 94.06 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.712 -1.131 . . . . 321.58999999999997 111.082 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 98.2 mttt -59.58 -40.5 87.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.191 -0.459 . . . . 491.97000000000003 111.155 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.537 ' O ' HG22 ' A' ' 24' ' ' ILE . 77.6 t -65.42 -44.32 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.879 0.371 . . . . 179.68000000000001 111.199 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -66.12 -42.23 89.47 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.775 0.657 . . . . 483.12 112.775 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 19' ' ' LEU . 44.0 pt -81.42 -27.64 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 113.394 0.887 . . . . 120.91 113.394 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.537 HG22 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -58.43 -35.73 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.534 0.207 . . . . 324.41000000000003 111.513 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.66 92.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 76.379999999999995 111.237 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.57 -41.74 89.47 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.158 -0.544 . . . . 59.560000000000002 112.828 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 37.8 m-85 -71.17 -24.97 62.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.635 0.235 . . . . 169.43000000000001 111.635 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.434 ' O ' HG23 ' A' ' 32' ' ' VAL . 34.7 t70 -75.45 -38.84 59.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.719 -0.219 . . . . 145.09 110.899 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.58 -41.28 98.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.924 0.392 . . . . 779.76999999999998 110.01 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.81 -39.97 96.99 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.732 -0.667 . . . . 72.329999999999998 112.275 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' PHE . 86.4 mt -64.59 -38.81 92.3 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.466 0.173 . . . . 213.66999999999999 111.466 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 28' ' ' ASP . 60.6 t -60.25 -46.0 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.67 -0.241 . . . . 275.81999999999999 110.878 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -63.59 -40.59 97.33 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.052 0.454 . . . . 545.0 110.389 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CH2' HD11 ' A' ' 42' ' ' LEU . 87.3 t90 -64.49 -42.24 95.97 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.695 -0.684 . . . . 999.99000000000001 110.279 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.9 mt -61.98 -36.94 82.99 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.816 -0.629 . . . . 205.93000000000001 111.296 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -61.6 -37.61 84.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.708 0.29 . . . . 557.46000000000004 111.275 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.4 t -87.35 -50.51 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 113.378 0.881 . . . . 284.56999999999999 113.378 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.576 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.13 -29.46 8.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.251 0.834 . . . . 350.44 113.251 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.56 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.7 -35.09 84.93 Favored Glycine 0 N--CA 1.462 0.37 0 CA-C-N 116.588 -0.278 . . . . 199.69999999999999 113.793 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -58.2 -39.49 79.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.961 0.356 . . . . 999.99000000000001 111.961 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.9 p -87.3 -10.15 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.749 0.648 . . . . 302.80000000000001 112.749 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 98.0 mt -73.39 150.98 41.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.134 0.492 . . . . 581.97000000000003 111.963 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.4 m -77.08 162.79 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.673 . . . . 239.06999999999999 110.565 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.5 m -59.9 -41.13 90.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.216 -0.447 . . . . 192.00999999999999 111.187 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.431 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 77.8 t -65.64 -41.71 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.27 -0.423 . . . . 278.44999999999999 110.642 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.94 -39.84 95.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.085 -0.507 . . . . 316.42000000000002 110.913 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -61.83 -44.25 97.22 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.238 -0.437 . . . . 470.35000000000002 110.789 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -39.31 93.84 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.277 -0.42 . . . . 369.77999999999997 110.92 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -23.89 66.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.777 -0.647 . . . . 66.790000000000006 112.149 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.2 -37.36 82.7 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.285 0.476 . . . . 238.30000000000001 112.285 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -59.01 -46.94 86.93 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.157 -0.683 . . . . 526.92999999999995 109.157 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -62.21 -44.23 97.04 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.422 -0.808 . . . . 162.88 110.421 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.4 t -61.15 -42.46 93.38 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 CA-C-N 116.451 -0.341 . . . . 139.00999999999999 110.492 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.45 -40.33 90.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.229 -0.441 . . . . 198.61000000000001 111.051 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -61.15 -46.96 88.38 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.001 -0.37 . . . . 999.99000000000001 110.001 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -64.73 -39.37 93.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.375 0.607 . . . . 799.64999999999998 110.21 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' A' ' 96' ' ' ILE . 90.9 t80 -58.36 -47.75 82.81 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.121 -0.945 . . . . 151.58000000000001 110.586 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.0 ttt -60.48 -45.24 94.48 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 168.43000000000001 110.816 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.66 ' HG2' HG13 ' A' ' 131' ' ' VAL . 53.0 mt-30 -62.32 -39.26 92.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 530.55999999999995 111.653 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.9 m -60.51 -48.24 82.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.397 -0.365 . . . . 293.49000000000001 110.976 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.478 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 82.7 m-70 -70.22 -39.13 75.29 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.425 -0.352 . . . . 383.72000000000003 111.204 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -61.4 -45.43 94.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.966 -0.561 . . . . 497.0 111.452 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.28 87.56 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 111.729 0.27 . . . . 177.0 111.729 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -62.78 -46.08 89.66 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.928 0.394 . . . . 478.75999999999999 111.129 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.478 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 48.9 m-85 -70.68 -33.82 71.32 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.137 -0.483 . . . . 727.09000000000003 111.761 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 1.8 mmt -49.09 -41.33 35.31 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.909 0.707 . . . . 664.46000000000004 112.909 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.4 mt -61.96 -43.91 97.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.718 0.294 . . . . 447.74000000000001 111.111 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -70.17 -43.93 69.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 999.99000000000001 111.051 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 73' ' ' ILE . 97.2 mt -63.65 -47.92 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 115.619 -0.719 . . . . 398.94999999999999 111.922 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -62.55 -40.64 97.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.317 -0.401 . . . . 366.97000000000003 111.685 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.7 -46.8 89.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.671 -0.24 . . . . 709.00999999999999 110.918 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -65.85 -41.79 91.28 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.555 -0.293 . . . . 931.13999999999999 111.529 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.9 mm -65.16 -46.38 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.491 -0.322 . . . . 175.25999999999999 111.04 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -62.99 -43.61 98.31 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.269 -0.423 . . . . 443.19 111.783 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.26 97.0 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.459 -0.337 . . . . 366.44 111.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.66 -42.62 50.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.028 0.442 . . . . 386.93000000000001 111.012 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.89 -14.69 64.56 Favored Glycine 0 CA--C 1.518 0.234 0 CA-C-N 115.845 -0.616 . . . . 244.66999999999999 112.431 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -75.57 139.06 41.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.596 0.236 . . . . 999.99000000000001 110.85 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 68.7 p -75.36 139.4 71.7 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.747 -0.206 . . . . 263.29000000000002 110.653 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.47 142.56 33.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.423 2.082 . . . . 173.88999999999999 112.924 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.532 HG23 ' H ' ' A' ' 84' ' ' ASP . 18.6 m -102.87 171.42 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.503 . . . . 201.66 111.095 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 76.8 t -60.78 -42.52 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.305 -0.407 . . . . 81.090000000000003 110.52 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.31 96.02 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.957 -0.64 . . . . 106.63 112.234 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.532 ' H ' HG23 ' A' ' 81' ' ' VAL . 38.1 t70 -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.826 0.346 . . . . 397.23000000000002 110.178 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.419 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 28.2 m-85 -62.96 -41.78 99.63 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.935 -0.575 . . . . 176.41 111.226 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 77.2 p -68.03 -36.37 79.82 Favored 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 111.847 0.314 . . . . 224.31999999999999 111.847 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.9 -41.66 95.41 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.032 0.444 . . . . 999.99000000000001 110.15 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -69.37 -39.02 78.29 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.629 -0.714 . . . . 158.16999999999999 110.205 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.52 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.19 -36.73 93.41 Favored Glycine 0 C--N 1.333 0.365 0 CA-C-N 115.176 -0.92 . . . . 65.709999999999994 113.175 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.9 85.08 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.427 0.156 . . . . 95.379999999999995 111.209 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.97 -40.66 96.35 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.969 0.414 . . . . 381.13999999999999 110.252 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -64.53 -43.58 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.828 -0.624 . . . . 182.12 110.545 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . -64.44 -22.45 67.62 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.719 -0.673 . . . . 88.799999999999997 113.95 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.2 -14.2 58.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.034 0.417 . . . . 999.99000000000001 111.489 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.75 115.38 29.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.632 0.253 . . . . 999.99000000000001 110.866 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.492 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 43.4 pt -129.78 147.44 33.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.996 0.427 . . . . 308.67000000000002 111.241 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -148.08 34.98 0.82 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.0 -0.546 . . . . 388.05000000000001 110.976 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.9 mmm -61.95 -39.5 92.32 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.189 -0.46 . . . . 360.56999999999999 111.382 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.7 88.98 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.174 -0.466 . . . . 184.22999999999999 111.104 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -68.94 -30.94 69.49 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.756 -0.656 . . . . 999.99000000000001 111.666 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.78 -49.65 76.88 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.751 0.31 . . . . 374.13 110.833 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -66.87 -37.14 83.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.462 -0.335 . . . . 999.99000000000001 111.309 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.97 -44.46 97.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.415 -0.357 . . . . 558.87 110.385 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.18 -41.65 99.24 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.029 -0.532 . . . . 332.85000000000002 111.114 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.05 -41.49 90.74 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.07 -0.514 . . . . 472.20999999999998 110.754 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -62.55 -41.12 98.69 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.119 -0.491 . . . . 821.44000000000005 110.65 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.56 -40.2 78.36 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.975 -0.557 . . . . 746.24000000000001 111.314 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.2 -4.42 59.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.313 -0.403 . . . . 999.99000000000001 111.04 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 57.64 39.85 27.15 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.851 -0.613 . . . . 675.44000000000005 111.428 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 98.7 mmm -108.36 114.25 27.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.424 -0.353 . . . . 999.99000000000001 111.321 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.1 mt -94.44 118.99 66.96 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 390.38 109.831 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.72 126.72 12.31 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.019 1.812 . . . . 243.11000000000001 113.053 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -87.11 156.41 19.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.768 -0.651 . . . . 618.10000000000002 110.774 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.431 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 75.4 t80 -67.27 125.92 27.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.025 -0.361 . . . . 999.99000000000001 110.025 178.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.3 mt -98.62 138.08 20.71 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.535 -0.302 . . . . 415.25 111.363 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.84 -23.17 55.48 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.655 2.237 . . . . 529.14999999999998 111.861 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -63.84 -30.17 71.29 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.559 -0.746 . . . . 516.88 110.822 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.6 mtt -60.13 -39.16 85.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.962 -0.563 . . . . 914.60000000000002 110.66 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -61.09 -40.87 95.35 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.215 -0.448 . . . . 675.30999999999995 110.69 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.27 -41.11 97.07 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.137 -0.483 . . . . 900.95000000000005 111.069 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.98 -44.53 99.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.351 -0.386 . . . . 300.73000000000002 110.816 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.54 -39.63 94.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.392 -0.367 . . . . 595.28999999999996 111.632 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -68.01 -33.43 74.6 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.206 0.447 . . . . 999.99000000000001 112.206 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -83.33 130.45 35.06 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.08 0.4 . . . . 385.68000000000001 112.08 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -53.6 145.66 28.41 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 115.731 -0.668 . . . . 999.99000000000001 111.117 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -27.47 84.92 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.609 2.206 . . . . 149.59999999999999 112.618 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.749 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -71.07 -19.75 62.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 147.02000000000001 111.29 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -103.5 12.69 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.334 -0.394 . . . . 360.37 111.194 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.4 t -98.82 110.43 57.33 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.834 0.35 . . . . 187.93000000000001 110.696 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.94 166.59 26.58 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.091 2.527 . . . . 265.38999999999999 112.957 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.66 HG13 ' HG2' ' A' ' 59' ' ' GLN . 64.7 t -107.37 136.33 42.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.047 -0.723 . . . . 246.78 109.047 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -115.67 131.11 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.875 0.369 . . . . 999.99000000000001 110.191 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -76.53 158.58 31.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.304 0.573 . . . . 495.41000000000003 112.21 -178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 74.3 mmm . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.264 -0.874 . . . . 761.34000000000003 111.526 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.086 0.47 . . . . 375.51999999999998 110.456 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -89.82 119.61 69.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.948 -0.569 . . . . 999.99000000000001 110.217 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.99 137.76 82.54 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.537 2.158 . . . . 436.63 112.386 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -106.81 -67.1 0.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 999.99000000000001 111.601 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -105.43 4.27 30.5 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.024 0.379 . . . . 999.99000000000001 112.024 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.64 125.25 22.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.58 -0.282 . . . . 781.60000000000002 110.957 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -99.53 112.02 24.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.339 . . . . 216.75 110.632 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -61.89 -39.67 92.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.795 -0.639 . . . . 902.89999999999998 111.354 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.81 80.03 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.367 -0.379 . . . . 121.34999999999999 111.983 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -64.09 -36.06 82.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.414 -0.357 . . . . 265.05000000000001 110.123 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 79.2 mm-40 -64.87 -40.39 95.04 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.921 -0.581 . . . . 524.44000000000005 110.078 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.4 -47.65 92.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 115.654 -0.703 . . . . 214.56 111.631 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -40.67 97.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 61.909999999999997 111.049 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.763 HD22 ' HB3' ' A' ' 85' ' ' TYR . 60.1 tp -65.57 -41.74 92.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.903 -0.59 . . . . 321.58999999999997 111.615 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG12 ' A' ' 24' ' ' ILE . 57.1 mtmt -60.24 -38.64 84.06 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.589 -0.278 . . . . 491.97000000000003 111.488 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.4 t -63.39 -43.68 98.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.635 0.255 . . . . 179.68000000000001 110.349 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -65.7 -40.39 92.23 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.365 -0.38 . . . . 483.12 110.708 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -42.41 94.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.94 -0.573 . . . . 120.91 110.915 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 20' ' ' LYS . 26.9 mm -60.07 -42.79 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.069 -0.514 . . . . 324.41000000000003 111.328 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.29 -42.97 96.6 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 111.559 0.207 . . . . 76.379999999999995 111.559 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.98 -44.3 96.15 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.744 -0.741 . . . . 59.560000000000002 112.848 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -73.03 -20.41 61.0 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.77 0.285 . . . . 169.43000000000001 111.77 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -75.63 -39.54 57.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.041 -0.355 . . . . 145.09 110.041 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -63.95 -42.0 97.43 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.328 -0.619 . . . . 779.76999999999998 109.328 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.469 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -64.53 -39.78 97.1 Favored Glycine 0 CA--C 1.52 0.374 0 CA-C-N 115.551 -0.749 . . . . 72.329999999999998 112.282 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 66.5 tp -59.19 -46.3 88.78 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.181 0.437 . . . . 213.66999999999999 112.181 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -27.08 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 120.835 -0.346 . . . . 275.81999999999999 111.883 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -63.86 -40.71 97.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.826 0.346 . . . . 545.0 110.937 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 2.7 m-90 -78.4 -31.77 48.44 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.773 0.321 . . . . 999.99000000000001 111.184 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 91.7 mt -63.02 -39.81 95.88 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.2 -0.454 . . . . 205.93000000000001 111.681 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -71.04 -19.31 62.51 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.886 0.328 . . . . 557.46000000000004 111.886 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.3 t -85.84 -44.88 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.734 0.302 . . . . 284.56999999999999 111.767 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -100.46 9.62 42.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.758 0.313 . . . . 350.44 111.547 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.25 -19.63 70.53 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.127 -0.488 . . . . 199.69999999999999 114.199 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.552 ' HG3' HG23 ' A' ' 41' ' ' THR . 52.0 ptt85 -64.15 -34.42 78.02 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.177 0.488 . . . . 999.99000000000001 112.226 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.552 HG23 ' HG3' ' A' ' 40' ' ' ARG . 58.5 p -114.05 -0.13 14.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.855 0.359 . . . . 302.80000000000001 111.79 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -72.31 124.95 26.17 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 581.97000000000003 111.836 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.9 m -77.82 158.91 29.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 239.06999999999999 110.705 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -60.67 -43.35 97.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.871 0.367 . . . . 192.00999999999999 111.203 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.604 HG13 ' HB2' ' A' ' 114' ' ' TYR . 67.3 t -66.62 -41.65 88.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.096 -0.502 . . . . 278.44999999999999 110.824 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 97.1 mt-30 -62.95 -39.54 94.96 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.967 -0.56 . . . . 316.42000000000002 111.511 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.05 -47.32 86.37 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.627 0.251 . . . . 470.35000000000002 111.105 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -65.21 -39.55 92.94 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.848 0.356 . . . . 369.77999999999997 110.858 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.92 86.55 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.838 -0.619 . . . . 66.790000000000006 111.363 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.0 mt -61.31 -36.42 80.06 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.042 -0.527 . . . . 238.30000000000001 112.244 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -59.54 -41.17 89.45 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.676 -0.49 . . . . 526.92999999999995 109.676 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -67.26 -41.44 85.54 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.864 -0.607 . . . . 162.88 110.039 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.79 -42.94 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.97 -0.559 . . . . 139.00999999999999 110.502 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -60.07 -42.78 95.29 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.078 -0.51 . . . . 198.61000000000001 110.539 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -63.32 -42.67 99.0 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.328 -0.396 . . . . 999.99000000000001 110.567 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -63.95 -43.08 96.88 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.138 0.494 . . . . 799.64999999999998 110.242 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -60.32 -47.35 86.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.335 -0.848 . . . . 151.58000000000001 110.51 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttp -60.0 -44.16 94.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.666 -0.697 . . . . 168.43000000000001 110.851 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.62 -41.51 99.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.113 -0.494 . . . . 530.55999999999995 110.976 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.0 m -62.5 -47.06 85.6 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.287 -0.415 . . . . 293.49000000000001 111.231 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -64.37 -47.07 80.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.041 -0.527 . . . . 383.72000000000003 110.75 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -62.82 -47.73 82.14 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.345 0.498 . . . . 497.0 112.345 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.79 78.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.784 0.661 . . . . 177.0 112.784 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.99 -50.36 74.38 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 121.223 -0.191 . . . . 478.75999999999999 111.341 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -73.02 -41.06 64.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.731 0.3 . . . . 727.09000000000003 111.209 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.4 tmm? -54.71 -47.32 73.87 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.709 -0.678 . . . . 664.46000000000004 112.327 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.3 mt -61.35 -41.09 96.49 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 111.928 0.344 . . . . 447.74000000000001 111.928 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -62.51 -47.9 81.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 999.99000000000001 111.494 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.6 tt -78.47 -32.19 16.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.621 0.6 . . . . 398.94999999999999 112.621 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -60.95 -41.5 96.42 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.63 0.252 . . . . 366.97000000000003 111.225 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -60.68 -45.98 92.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 709.00999999999999 110.254 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.17 -43.03 93.02 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.907 -0.588 . . . . 931.13999999999999 111.474 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.34 -46.36 95.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-O 120.785 0.326 . . . . 175.25999999999999 111.394 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.45 -45.1 94.62 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.168 -0.469 . . . . 443.19 111.27 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.3 95.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.438 -0.346 . . . . 366.44 111.81 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.48 -38.48 81.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.557 -0.292 . . . . 386.93000000000001 111.502 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.22 6.92 70.64 Favored Glycine 0 CA--C 1.518 0.259 0 C-N-CA 120.772 -0.728 . . . . 244.66999999999999 112.465 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -74.04 151.23 40.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.846 0.355 . . . . 999.99000000000001 110.981 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.7 p -114.91 95.08 40.4 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 263.29000000000002 111.238 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -72.31 155.79 55.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.731 2.287 . . . . 173.88999999999999 112.66 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.5 m -100.3 175.49 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 201.66 111.445 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.0 t -60.19 -40.88 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.147 -0.479 . . . . 81.090000000000003 111.193 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.4 -39.69 95.13 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.842 -0.694 . . . . 106.63 112.475 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.31 -40.18 95.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.022 0.439 . . . . 397.23000000000002 110.347 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.763 ' HB3' HD22 ' A' ' 19' ' ' LEU . 42.8 m-85 -68.47 -39.19 81.48 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.68 -0.691 . . . . 176.41 111.838 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.9 p -66.42 -29.66 69.85 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.835 0.309 . . . . 224.31999999999999 111.835 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -63.57 -42.14 98.35 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.01 0.433 . . . . 999.99000000000001 110.056 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.26 -41.0 74.05 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.812 -0.631 . . . . 158.16999999999999 110.493 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.09 -40.4 99.17 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.417 -0.811 . . . . 65.709999999999994 112.95 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.44 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.57 -41.97 98.16 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.432 0.158 . . . . 95.379999999999995 111.301 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.93 -41.86 97.51 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.936 0.398 . . . . 381.13999999999999 110.55 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 92.8 mt -65.27 -42.9 95.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.768 -0.651 . . . . 182.12 110.912 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.32 -20.92 65.88 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 116.019 -0.537 . . . . 88.799999999999997 113.544 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 95.7 mtt-85 -79.44 -17.54 54.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.916 0.358 . . . . 999.99000000000001 111.42 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -108.71 110.93 22.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.885 0.374 . . . . 999.99000000000001 110.88 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.8 mt -129.39 125.55 62.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.831 -0.433 . . . . 308.67000000000002 109.831 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -122.46 51.56 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.976 0.417 . . . . 388.05000000000001 110.999 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.4 ptm -91.96 -9.73 41.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.123 -0.49 . . . . 360.56999999999999 111.837 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.47 95.91 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.837 0.351 . . . . 184.22999999999999 111.753 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -70.06 -28.24 65.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.465 . . . . 999.99000000000001 111.247 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -58.2 -46.57 85.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.339 -0.391 . . . . 374.13 111.217 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.608 0.242 . . . . 999.99000000000001 111.11 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.5 -45.3 69.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.349 -0.387 . . . . 558.87 110.908 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.17 96.07 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.98 -0.554 . . . . 332.85000000000002 111.816 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.38 -47.89 84.13 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.421 -0.354 . . . . 472.20999999999998 110.83 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -64.27 -40.25 95.61 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.272 -0.422 . . . . 821.44000000000005 111.102 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.09 -39.05 80.99 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.001 -0.545 . . . . 746.24000000000001 112.16 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -83.0 -11.94 57.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 111.66 0.244 . . . . 999.99000000000001 111.66 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.8 t30 52.56 48.64 22.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.027 0.441 . . . . 675.44000000000005 111.391 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 19.2 mmt -122.98 102.67 8.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.369 -0.378 . . . . 999.99000000000001 110.84 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.2 mt -93.93 117.57 67.21 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.492 -0.322 . . . . 390.38 110.326 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.36 149.48 50.78 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.439 2.093 . . . . 243.11000000000001 112.846 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -84.59 147.16 27.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 618.10000000000002 110.227 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.604 ' HB2' HG13 ' A' ' 45' ' ' VAL . 76.5 t80 -66.77 123.04 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 999.99000000000001 110.689 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 85.6 mt -98.89 120.73 57.97 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.083 -0.508 . . . . 415.25 111.447 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.67 -28.45 81.62 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.025 2.484 . . . . 529.14999999999998 112.37 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.49 -29.0 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.704 -0.68 . . . . 516.88 111.709 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 66.6 mtt -60.01 -39.21 85.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.568 -0.287 . . . . 914.60000000000002 110.758 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.41 -40.72 95.42 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.176 -0.465 . . . . 675.30999999999995 110.936 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -62.12 -44.38 96.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.174 -0.466 . . . . 900.95000000000005 110.966 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.51 -45.09 99.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.353 -0.385 . . . . 300.73000000000002 111.11 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -63.09 -40.89 98.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.251 -0.431 . . . . 595.28999999999996 112.007 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -66.35 -33.71 76.33 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.383 0.512 . . . . 999.99000000000001 112.383 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.8 mtm -80.25 136.98 36.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.789 0.328 . . . . 385.68000000000001 111.665 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.496 ' O ' HG23 ' A' ' 129' ' ' VAL . 77.3 mtp85 -53.4 144.12 32.9 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 115.815 -0.63 . . . . 999.99000000000001 111.165 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -52.89 -33.95 63.89 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.233 2.622 . . . . 149.59999999999999 113.061 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.79 -36.37 78.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 147.02000000000001 111.809 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.45 -0.51 57.63 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.972 0.36 . . . . 360.37 111.972 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.9 t -91.7 114.61 62.48 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.705 0.288 . . . . 187.93000000000001 111.022 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.04 157.9 50.3 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.653 2.235 . . . . 265.38999999999999 112.352 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 m -120.61 155.89 23.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.299 -0.41 . . . . 246.78 110.761 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -98.26 119.59 37.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.025 0.441 . . . . 999.99000000000001 111.381 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -84.37 155.69 22.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.767 -0.651 . . . . 495.41000000000003 109.911 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.261 -0.876 . . . . 761.34000000000003 111.051 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.2 t . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.903 0.382 . . . . 375.51999999999998 110.413 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.99 156.07 72.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.424 . . . . 999.99000000000001 110.986 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.32 151.37 65.84 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.464 2.109 . . . . 436.63 112.323 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.52 ' HG3' ' CD1' ' A' ' 10' ' ' PHE . 22.5 tptm -104.0 123.57 47.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 999.99000000000001 110.305 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.52 ' CD1' ' HG3' ' A' ' 9' ' ' LYS . 75.3 m-85 59.01 39.4 23.53 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.575 0.547 . . . . 999.99000000000001 111.683 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -56.99 120.02 7.26 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.869 0.366 . . . . 781.60000000000002 111.278 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -114.3 123.35 49.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.322 -0.399 . . . . 216.75 110.154 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -61.87 -39.48 92.06 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.399 -0.364 . . . . 902.89999999999998 111.213 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.75 -38.41 81.66 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.144 -0.48 . . . . 121.34999999999999 111.616 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -71.25 -25.48 62.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 265.05000000000001 111.438 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.08 -40.11 96.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.276 -0.42 . . . . 524.44000000000005 112.115 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -72.82 -27.19 24.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 120.782 -0.367 . . . . 214.56 111.633 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.87 93.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.326 0.584 . . . . 61.909999999999997 109.631 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.405 HD13 ' CZ2' ' A' ' 62' ' ' TRP . 56.8 mt -64.08 -41.16 97.41 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.123 -0.944 . . . . 321.58999999999997 111.206 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.41 -40.15 93.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.992 -0.549 . . . . 491.97000000000003 111.788 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.6 t -64.51 -45.95 94.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.582 -0.281 . . . . 179.68000000000001 111.51 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.86 -41.15 75.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.958 0.355 . . . . 483.12 111.958 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.403 ' O ' ' HD1' ' A' ' 27' ' ' PHE . 96.7 mt -66.95 -44.8 88.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.404 -0.362 . . . . 120.91 111.933 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.2 tt -63.18 -32.74 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 111.964 0.357 . . . . 324.41000000000003 111.964 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.66 -45.95 92.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.407 -0.36 . . . . 76.379999999999995 111.457 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.18 -41.94 91.73 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.753 -0.737 . . . . 59.560000000000002 112.617 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 43.8 m-85 -70.27 -28.05 64.91 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.74 0.274 . . . . 169.43000000000001 111.74 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -40.99 46.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.436 -0.209 . . . . 145.09 110.436 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -62.85 -44.56 95.81 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.622 -0.51 . . . . 779.76999999999998 109.622 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -38.64 96.65 Favored Glycine 0 C--N 1.335 0.489 0 CA-C-N 115.464 -0.789 . . . . 72.329999999999998 112.226 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 tp -64.09 -42.96 96.73 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.736 0.303 . . . . 213.66999999999999 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.51 -45.26 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.983 -0.553 . . . . 275.81999999999999 110.598 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -62.5 -40.59 97.2 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.838 0.351 . . . . 545.0 110.473 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -63.13 -43.95 96.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.995 -0.548 . . . . 999.99000000000001 110.033 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' HG3' ' A' ' 47' ' ' LYS . 85.8 mt -62.46 -37.93 87.85 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.698 -0.683 . . . . 205.93000000000001 111.214 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.71 -37.74 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.688 0.28 . . . . 557.46000000000004 111.579 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.6 t -87.33 -50.66 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 113.525 0.935 . . . . 284.56999999999999 113.525 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.9 m80 -101.9 -27.56 12.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.022 0.749 . . . . 350.44 113.022 -177.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.566 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -72.08 -11.7 75.0 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.07 -0.586 . . . . 199.69999999999999 113.401 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -60.85 -39.92 90.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.819 0.303 . . . . 999.99000000000001 111.819 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 76.6 p -97.85 -8.13 28.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.246 0.461 . . . . 302.80000000000001 112.246 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.566 HD12 ' HA2' ' A' ' 39' ' ' GLY . 97.2 mt -73.11 150.7 42.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.064 0.459 . . . . 581.97000000000003 111.819 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 m -72.72 161.86 30.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.753 -0.658 . . . . 239.06999999999999 110.642 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -59.48 -40.1 85.86 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.109 -0.496 . . . . 192.00999999999999 111.12 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HB2' ' A' ' 114' ' ' TYR . 55.8 t -65.15 -43.46 95.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.415 . . . . 278.44999999999999 110.852 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.88 -39.96 94.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.269 -0.423 . . . . 316.42000000000002 111.054 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG3' HD22 ' A' ' 35' ' ' LEU . 87.8 tttt -61.32 -47.18 87.13 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.277 -0.419 . . . . 470.35000000000002 110.795 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.41 -38.61 90.46 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.277 -0.419 . . . . 369.77999999999997 111.399 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.53 86.07 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.126 -0.488 . . . . 66.790000000000006 111.608 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -60.11 -30.67 69.42 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.171 -0.468 . . . . 238.30000000000001 111.99 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -62.35 -41.2 98.4 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.631 0.253 . . . . 526.92999999999995 110.769 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -66.58 -41.01 89.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.112 0.482 . . . . 162.88 110.122 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.481 HG22 HH21 ' A' ' 56' ' ' ARG . 62.6 t -60.86 -41.31 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 115.418 -0.81 . . . . 139.00999999999999 110.502 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.79 -42.15 88.35 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.928 -0.578 . . . . 198.61000000000001 110.506 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -63.28 -44.57 94.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.511 -0.313 . . . . 999.99000000000001 110.975 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.481 HH21 HG22 ' A' ' 53' ' ' VAL . 80.7 mtm180 -65.27 -42.41 93.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.989 0.423 . . . . 799.64999999999998 111.168 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -62.05 -44.43 96.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.535 -0.757 . . . . 151.58000000000001 110.499 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 9.0 ttp -59.4 -40.88 88.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.864 -0.607 . . . . 168.43000000000001 110.744 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.19 -42.54 99.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.169 -0.469 . . . . 530.55999999999995 111.365 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 134' ' ' MET . 75.4 p -71.39 -37.87 71.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.806 0.336 . . . . 293.49000000000001 111.116 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -63.99 -44.86 91.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.034 -0.53 . . . . 383.72000000000003 109.683 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.405 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 38.6 t-105 -61.74 -45.47 93.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.367 -0.833 . . . . 497.0 111.918 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.41 77.99 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.511 0.56 . . . . 177.0 112.511 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -62.13 -41.49 98.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.722 0.267 . . . . 478.75999999999999 111.722 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -82.52 -33.73 28.15 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.623 -0.262 . . . . 727.09000000000003 111.527 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.2 ttp -53.17 -43.93 67.46 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.988 -0.551 . . . . 664.46000000000004 112.02 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 98.1 mt -60.87 -41.41 95.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.295 -0.411 . . . . 447.74000000000001 111.339 -178.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -69.03 -39.74 79.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.473 -0.331 . . . . 999.99000000000001 111.299 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.95 -45.34 99.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.038 -0.528 . . . . 398.94999999999999 111.349 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -62.33 -37.13 84.45 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.235 -0.439 . . . . 366.97000000000003 112.103 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -60.89 -42.89 98.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.631 0.253 . . . . 709.00999999999999 110.931 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -67.41 -42.46 83.23 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.358 -0.383 . . . . 931.13999999999999 111.419 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.93 -47.04 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.307 -0.406 . . . . 175.25999999999999 111.168 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -63.05 -43.95 97.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.161 -0.472 . . . . 443.19 111.452 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.47 -40.77 98.0 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.471 -0.331 . . . . 366.44 111.859 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.1 mt -70.26 -41.34 73.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.953 0.406 . . . . 386.93000000000001 111.278 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.52 -10.61 71.13 Favored Glycine 0 CA--C 1.52 0.36 0 CA-C-N 116.05 -0.523 . . . . 244.66999999999999 112.779 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.5 mpt_? -75.22 149.25 38.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.672 0.273 . . . . 999.99000000000001 111.347 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 74.9 p -72.24 138.48 81.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.387 -0.37 . . . . 263.29000000000002 110.585 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.0 136.99 23.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.291 1.994 . . . . 173.88999999999999 112.748 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 84' ' ' ASP . 14.7 m -104.37 155.14 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.243 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 79.6 t -63.58 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.17 -0.468 . . . . 81.090000000000003 111.169 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.63 97.7 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.745 -0.741 . . . . 106.63 112.608 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.522 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.2 t70 -64.38 -41.14 96.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.156 0.503 . . . . 397.23000000000002 109.807 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -63.0 -42.41 99.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.316 -0.856 . . . . 176.41 111.324 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -67.74 -36.2 80.13 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.9 -0.32 . . . . 224.31999999999999 110.932 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -62.83 -46.48 87.75 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.003 0.43 . . . . 999.99000000000001 110.01 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.27 -41.23 94.42 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.747 -0.661 . . . . 158.16999999999999 110.792 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.06 -41.07 99.67 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-N 115.97 -0.559 . . . . 65.709999999999994 112.413 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -62.26 -40.13 95.19 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.605 0.24 . . . . 95.379999999999995 110.95 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -66.98 -40.8 87.49 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.063 0.459 . . . . 381.13999999999999 110.467 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.5 mt -64.71 -41.5 92.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.562 -0.745 . . . . 182.12 111.031 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.09 -11.77 59.25 Favored Glycine 0 CA--C 1.52 0.384 0 CA-C-N 115.969 -0.559 . . . . 88.799999999999997 113.694 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 79.5 mtp85 -80.19 -10.96 59.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.069 0.434 . . . . 999.99000000000001 111.239 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.2 mmt85 -108.42 129.3 55.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.924 0.392 . . . . 999.99000000000001 110.925 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.83 -76.87 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.438 . . . . 308.67000000000002 111.093 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.1 t0 55.79 49.01 17.01 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.999 0.428 . . . . 388.05000000000001 111.649 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.6 mtm -86.52 -2.34 58.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.244 -0.435 . . . . 360.56999999999999 111.531 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.15 89.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.172 -0.467 . . . . 184.22999999999999 111.919 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -62.89 -39.02 93.2 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.257 -0.429 . . . . 999.99000000000001 111.868 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.485 ' CE2' HD11 ' A' ' 105' ' ' LEU . 86.7 t80 -58.97 -47.19 86.01 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.821 0.343 . . . . 374.13 110.736 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -59.75 -47.68 84.69 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.002 -0.544 . . . . 999.99000000000001 110.733 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.42 -39.21 89.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.039 -0.528 . . . . 558.87 110.931 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.41 95.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.152 -0.476 . . . . 332.85000000000002 111.317 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.485 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.24 -43.02 99.78 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.606 -0.27 . . . . 472.20999999999998 110.692 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.7 -44.39 93.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.226 -0.443 . . . . 821.44000000000005 110.721 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.45 -43.26 88.75 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.777 -0.647 . . . . 746.24000000000001 111.769 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -87.91 -5.16 58.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.385 -0.371 . . . . 999.99000000000001 111.647 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.16 43.68 26.37 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.935 0.494 . . . . 675.44000000000005 111.187 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.1 103.75 13.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 999.99000000000001 111.318 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -94.59 117.81 66.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.007 -0.542 . . . . 390.38 110.334 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.43 138.68 33.15 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.29 1.993 . . . . 243.11000000000001 112.887 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -86.27 144.27 27.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.935 -0.575 . . . . 618.10000000000002 110.957 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.607 ' HB2' HG13 ' A' ' 45' ' ' VAL . 47.0 t80 -68.95 99.17 1.03 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.728 0.299 . . . . 999.99000000000001 111.214 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.9 mt -98.74 123.34 50.06 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.419 -0.355 . . . . 415.25 110.975 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.81 -34.27 84.43 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.165 2.576 . . . . 529.14999999999998 112.479 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.98 -43.87 94.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.901 -0.59 . . . . 516.88 111.334 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.77 -41.14 90.4 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.474 -0.33 . . . . 914.60000000000002 110.535 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -61.77 -42.1 98.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.958 -0.565 . . . . 675.30999999999995 110.327 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.48 -43.42 98.86 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.003 -0.544 . . . . 900.95000000000005 111.452 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.578 HG23 HG21 ' A' ' 129' ' ' VAL . 34.6 mm -61.91 -46.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.76 0.314 . . . . 300.73000000000002 111.001 178.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -62.5 -40.8 97.89 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.098 -0.501 . . . . 595.28999999999996 111.378 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 67.4 ttp85 -64.86 -34.84 79.32 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.188 -0.46 . . . . 999.99000000000001 111.826 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.9 mtp -72.89 134.49 44.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.949 0.404 . . . . 385.68000000000001 111.753 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -53.85 145.05 33.57 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.517 -0.765 . . . . 999.99000000000001 111.3 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.57 -38.5 83.88 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.969 2.446 . . . . 149.59999999999999 112.942 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.45 75.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.572 . . . . 147.02000000000001 112.114 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -90.03 -15.0 32.71 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.205 0.817 . . . . 360.37 113.205 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.578 HG21 HG23 ' A' ' 121' ' ' ILE . 9.0 p -105.03 130.95 22.26 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 120.501 -0.479 . . . . 187.93000000000001 111.441 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -61.3 147.24 96.08 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.816 2.344 . . . . 265.38999999999999 112.491 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.2 m -126.3 152.31 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.211 -0.45 . . . . 246.78 110.394 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -118.84 127.7 53.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 999.99000000000001 110.992 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -84.49 80.54 9.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.037 -0.529 . . . . 495.41000000000003 110.478 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.605 ' HB2' HG22 ' A' ' 60' ' ' THR . 97.6 mtp . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.1 -0.953 . . . . 761.34000000000003 111.106 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.4 t . . . . . 0 C--O 1.232 0.179 0 N-CA-C 109.83 -0.433 . . . . 375.51999999999998 109.83 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.07 149.18 65.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 110.411 -0.218 . . . . 999.99000000000001 110.411 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.82 136.04 37.34 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.085 1.857 . . . . 436.63 112.367 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -120.63 -38.81 2.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 999.99000000000001 111.586 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -103.1 2.39 34.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.791 0.293 . . . . 999.99000000000001 111.791 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.1 tp -57.91 124.12 18.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.754 0.312 . . . . 781.60000000000002 110.743 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -113.26 120.1 40.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 216.75 110.495 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -62.1 -37.95 87.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 902.89999999999998 111.068 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.24 82.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.191 -0.458 . . . . 121.34999999999999 111.587 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -77.74 -20.39 53.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 265.05000000000001 110.976 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.39 -42.56 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 524.44000000000005 111.612 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.02 -32.55 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 120.961 -0.296 . . . . 214.56 111.685 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.57 -44.32 96.63 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.114 0.483 . . . . 61.909999999999997 110.252 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HB3' ' A' ' 85' ' ' TYR . 90.9 mt -69.51 -38.2 77.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.475 -0.784 . . . . 321.58999999999997 111.329 178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -59.03 -41.92 88.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.548 -0.751 . . . . 491.97000000000003 111.794 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.01 -44.69 99.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.527 0.204 . . . . 179.68000000000001 111.116 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.88 -40.78 91.92 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.82 0.343 . . . . 483.12 111.148 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.72 -42.78 95.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.913 -0.585 . . . . 120.91 111.503 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 86.8 mt -60.21 -42.5 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.391 -0.368 . . . . 324.41000000000003 111.621 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.87 94.89 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.079 -0.248 . . . . 76.379999999999995 111.42 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.416 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -66.61 -40.69 94.16 Favored Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.876 -0.678 . . . . 59.560000000000002 112.578 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -73.12 -18.34 61.3 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 122.762 0.425 . . . . 169.43000000000001 112.009 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.04 -38.96 61.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.787 0.291 . . . . 145.09 111.787 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 26' ' ' GLY . 16.7 ptm180 -66.19 -32.3 73.65 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 120.516 -0.474 . . . . 779.76999999999998 110.11 179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.96 -39.16 97.72 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 115.683 -0.69 . . . . 72.329999999999998 112.138 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 54' ' ' ASN . 84.2 mt -63.77 -39.28 93.87 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.55 0.214 . . . . 213.66999999999999 110.876 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.496 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 69.6 t -61.03 -46.73 96.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.16 -0.473 . . . . 275.81999999999999 111.095 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -64.23 -41.5 96.97 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.908 0.385 . . . . 545.0 110.979 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.56 ' O ' HG12 ' A' ' 37' ' ' VAL . 76.5 t90 -65.46 -43.33 90.7 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.404 0.621 . . . . 999.99000000000001 110.39 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 42' ' ' LEU . 48.0 tp -61.46 -33.19 73.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.187 -0.915 . . . . 205.93000000000001 112.487 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 32' ' ' VAL . 99.4 mtt180 -58.24 -28.49 64.95 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.38 0.881 . . . . 557.46000000000004 113.38 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 34' ' ' TRP . 8.6 p -84.5 -26.33 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.667 -0.413 . . . . 284.56999999999999 112.022 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -111.2 15.28 21.58 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.65 0.262 . . . . 350.44 111.257 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -39.81 97.81 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.066 -0.515 . . . . 199.69999999999999 114.293 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.53 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -65.12 -23.23 67.08 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.606 0.595 . . . . 999.99000000000001 112.606 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.53 HG23 ' HG3' ' A' ' 40' ' ' ARG . 44.6 p -112.83 11.65 19.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.046 0.387 . . . . 302.80000000000001 112.046 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 35' ' ' LEU . 56.6 tp -71.9 122.49 20.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 581.97000000000003 112.041 -179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 71.1 m -80.53 159.21 25.58 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.963 -0.562 . . . . 239.06999999999999 110.033 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -61.73 -43.77 98.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.659 0.266 . . . . 192.00999999999999 111.639 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -73.22 -31.22 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 111.7 0.259 . . . . 278.44999999999999 111.7 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -62.8 -38.54 91.09 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.784 0.29 . . . . 316.42000000000002 111.784 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -59.77 -46.26 89.74 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.732 0.301 . . . . 470.35000000000002 110.388 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.42 -39.0 91.6 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.221 -0.445 . . . . 369.77999999999997 110.396 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.53 -36.54 80.84 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.549 -0.75 . . . . 66.790000000000006 111.849 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.21 -36.68 78.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.372 -0.376 . . . . 238.30000000000001 111.904 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -61.22 -39.61 90.9 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.471 -0.566 . . . . 526.92999999999995 109.471 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.72 -39.84 88.18 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.757 -0.656 . . . . 162.88 109.776 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 63.2 t -60.11 -39.15 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.142 0 CA-C-N 115.741 -0.663 . . . . 139.00999999999999 110.461 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.583 ' HB2' HD11 ' A' ' 31' ' ' LEU . 29.2 t-20 -56.88 -47.05 81.37 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.327 -0.397 . . . . 198.61000000000001 110.799 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.97 -40.56 91.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.664 -0.244 . . . . 999.99000000000001 110.756 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -62.07 -45.49 93.28 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.056 0.455 . . . . 799.64999999999998 110.111 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -60.44 -47.04 87.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.571 -0.74 . . . . 151.58000000000001 110.157 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -46.9 88.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 168.43000000000001 111.474 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.499 ' HG2' HG23 ' A' ' 131' ' ' VAL . 77.5 mt-30 -62.85 -43.44 98.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.005 0.372 . . . . 530.55999999999995 112.005 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.3 p -71.57 -40.42 69.95 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.797 0.295 . . . . 293.49000000000001 111.797 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.435 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 61.1 t-80 -64.13 -47.56 79.47 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.875 0.369 . . . . 383.72000000000003 110.548 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -63.74 -44.15 94.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.747 -0.661 . . . . 497.0 112.081 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.64 83.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.796 0.665 . . . . 177.0 112.796 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -64.62 -40.89 96.29 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.921 0.341 . . . . 478.75999999999999 111.921 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 79.8 m-85 -81.49 -26.78 34.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.757 0.28 . . . . 727.09000000000003 111.757 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.5 ttp -52.54 -41.6 63.67 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.051 -0.522 . . . . 664.46000000000004 112.072 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.78 -44.61 90.7 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.663 -0.244 . . . . 447.74000000000001 111.494 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.6 m0 -67.36 -41.15 85.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 999.99000000000001 110.818 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 47.5 mm -67.37 -45.41 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 115.95 -0.568 . . . . 398.94999999999999 111.047 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.16 -41.93 97.65 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.949 -0.569 . . . . 366.97000000000003 111.47 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -60.18 -45.55 92.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.435 -0.348 . . . . 709.00999999999999 110.63 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.62 -42.66 95.36 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.402 -0.363 . . . . 931.13999999999999 111.269 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -63.8 -46.92 93.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.813 0.34 . . . . 175.25999999999999 111.164 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.43 -40.81 97.77 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.257 -0.429 . . . . 443.19 111.312 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.46 95.92 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.374 -0.375 . . . . 366.44 111.419 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.1 mt -69.77 -40.47 76.05 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.341 -0.39 . . . . 386.93000000000001 111.341 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 -8.22 79.59 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.044 -0.598 . . . . 244.66999999999999 112.507 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -74.76 153.06 38.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 999.99000000000001 111.707 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -108.53 95.96 17.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.008 -0.542 . . . . 263.29000000000002 110.651 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.89 147.61 55.96 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.552 2.168 . . . . 173.88999999999999 113.282 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -101.07 -175.37 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.615 -0.721 . . . . 201.66 111.142 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.3 t -58.77 -41.97 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.404 -0.362 . . . . 81.090000000000003 110.718 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.615 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.57 -40.62 98.1 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.658 -0.782 . . . . 106.63 112.181 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.15 -40.58 90.7 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 397.23000000000002 110.692 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.52 ' HB3' HD11 ' A' ' 19' ' ' LEU . 33.3 m-85 -69.18 -36.26 77.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.705 -0.68 . . . . 176.41 112.174 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.615 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.8 OUTLIER -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.638 0.236 . . . . 224.31999999999999 111.638 -179.089 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.21 -46.34 89.35 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.722 -0.473 . . . . 999.99000000000001 109.722 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.71 -39.82 84.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.582 -0.735 . . . . 158.16999999999999 110.423 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.66 99.2 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 115.717 -0.674 . . . . 65.709999999999994 112.436 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.77 -41.22 97.42 Favored 'General case' 0 C--N 1.335 -0.064 0 CA-C-O 120.745 0.307 . . . . 95.379999999999995 110.498 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.48 -40.06 95.46 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.039 -0.528 . . . . 381.13999999999999 110.596 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 37.4 mm -63.28 -43.65 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.948 -0.569 . . . . 182.12 110.383 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 -20.61 66.84 Favored Glycine 0 CA--C 1.521 0.457 0 CA-C-N 115.873 -0.603 . . . . 88.799999999999997 113.609 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 42.0 mmt180 -79.73 -16.12 56.22 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.939 0.369 . . . . 999.99000000000001 111.384 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 -107.7 111.72 24.06 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.015 -0.365 . . . . 999.99000000000001 110.015 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -125.44 125.33 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.412 -0.358 . . . . 308.67000000000002 110.164 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.6 70.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.986 0.422 . . . . 388.05000000000001 110.888 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.82 -29.01 66.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.885 -0.598 . . . . 360.56999999999999 110.764 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.03 79.88 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.532 -0.758 . . . . 184.22999999999999 111.405 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.44 -46.98 85.45 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.113 -0.494 . . . . 999.99000000000001 111.064 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.27 -48.17 81.29 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.781 0.324 . . . . 374.13 110.728 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.69 -47.96 83.92 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.987 -0.551 . . . . 999.99000000000001 110.995 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -62.2 -39.08 91.55 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.055 -0.52 . . . . 558.87 111.609 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.47 94.57 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.384 -0.371 . . . . 332.85000000000002 111.265 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 90.2 mt -63.33 -40.83 98.37 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.304 -0.407 . . . . 472.20999999999998 110.667 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -64.7 -40.18 94.93 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.008 -0.542 . . . . 821.44000000000005 110.903 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.32 -43.36 88.16 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.882 -0.599 . . . . 746.24000000000001 111.525 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt -87.19 -6.92 58.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.241 -0.436 . . . . 999.99000000000001 111.472 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 56.42 37.24 28.65 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.956 0.502 . . . . 675.44000000000005 111.334 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.8 ttp -116.89 117.37 29.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 999.99000000000001 111.311 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.75 119.54 65.96 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.051 -0.522 . . . . 390.38 110.224 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.07 138.87 87.91 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.515 2.143 . . . . 243.11000000000001 112.33 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -85.49 119.52 25.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.414 -0.357 . . . . 618.10000000000002 110.966 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -70.01 89.84 0.62 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.068 -0.514 . . . . 999.99000000000001 110.562 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 86.4 mt -97.8 141.93 23.76 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 112.006 0.372 . . . . 415.25 112.006 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.4 Cg_exo -58.6 -33.04 97.88 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.237 2.625 . . . . 529.14999999999998 112.575 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -59.72 -44.54 93.68 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.077 -0.51 . . . . 516.88 111.203 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 65.6 mtt -60.51 -40.2 90.55 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.798 -0.445 . . . . 914.60000000000002 109.798 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.94 -40.57 96.0 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.619 -0.718 . . . . 675.30999999999995 110.444 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.14 -39.79 94.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.694 -0.685 . . . . 900.95000000000005 111.072 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.3 mt -61.09 -43.64 96.67 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.434 -0.348 . . . . 300.73000000000002 110.73 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.77 -37.78 83.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.258 -0.428 . . . . 595.28999999999996 110.336 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -64.11 -33.39 75.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.64 . . . . 999.99000000000001 110.758 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 69.6 mtm -68.47 140.0 55.72 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.462 -0.335 . . . . 385.68000000000001 110.956 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.472 ' O ' HG23 ' A' ' 129' ' ' VAL . 55.6 mmm-85 -52.46 137.48 41.09 Favored Pre-proline 0 N--CA 1.465 0.302 0 CA-C-N 115.892 -0.595 . . . . 999.99000000000001 111.51 178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -35.13 79.01 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.316 2.677 . . . . 149.59999999999999 113.229 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.1 77.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 147.02000000000001 112.106 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.75 -1.98 57.83 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.87 0.322 . . . . 360.37 111.87 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 125' ' ' ARG . 68.7 t -98.59 115.75 65.66 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.679 0.276 . . . . 187.93000000000001 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.57 156.09 61.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.671 2.247 . . . . 265.38999999999999 112.473 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.499 HG23 ' HG2' ' A' ' 59' ' ' GLN . 3.5 p -106.89 139.78 27.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 246.78 110.448 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -107.87 131.88 54.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.057 0.456 . . . . 999.99000000000001 110.879 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -83.95 156.71 22.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.848 -0.614 . . . . 495.41000000000003 110.733 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.2 mmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.425 -0.798 . . . . 761.34000000000003 111.045 -179.6 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 C--O 1.233 0.236 0 N-CA-C 110.234 -0.284 . . . . 375.51999999999998 110.234 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.05 149.82 70.61 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.881 0.372 . . . . 999.99000000000001 111.376 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.25 161.21 45.15 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.052 2.501 . . . . 436.63 113.076 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.0 mttp 67.42 17.32 10.1 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.428 -0.805 . . . . 999.99000000000001 112.258 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -62.28 -50.09 73.08 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.079 0.466 . . . . 999.99000000000001 110.378 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.06 139.84 56.43 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.411 -0.813 . . . . 781.60000000000002 111.245 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -61.69 129.83 42.95 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.396 -0.365 . . . . 216.75 110.293 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -63.24 -20.34 65.36 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.556 0.576 . . . . 902.89999999999998 112.556 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.3 -39.09 81.91 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.75 0.309 . . . . 121.34999999999999 111.632 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -68.37 -30.45 69.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 265.05000000000001 110.885 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.25 -39.68 94.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 524.44000000000005 110.76 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.6 -48.98 86.26 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-N 116.148 -0.478 . . . . 214.56 111.386 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.25 -41.69 99.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.023 -0.535 . . . . 61.909999999999997 111.433 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 85' ' ' TYR . 51.6 tp -66.5 -41.42 88.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 321.58999999999997 111.392 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -59.28 -35.24 73.4 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.952 -0.567 . . . . 491.97000000000003 112.054 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.17 -44.15 98.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.822 0.344 . . . . 179.68000000000001 110.291 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -69.97 -38.57 76.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.961 0.41 . . . . 483.12 110.465 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.8 mt -61.05 -47.09 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.765 0.654 . . . . 120.91 112.765 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 32.9 pt -60.26 -36.22 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 112.775 0.657 . . . . 324.41000000000003 112.775 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.91 -46.22 90.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.665 0.269 . . . . 76.379999999999995 111.361 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.67 -41.14 89.95 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 121.138 -0.554 . . . . 59.560000000000002 112.888 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -73.62 -21.09 60.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.268 . . . . 169.43000000000001 111.704 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 32' ' ' VAL . 16.3 t70 -77.12 -40.23 46.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.684 -0.235 . . . . 145.09 110.705 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.07 -42.38 99.65 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.001 0.429 . . . . 779.76999999999998 109.954 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -65.48 -39.59 95.74 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.639 -0.709 . . . . 72.329999999999998 111.773 178.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.9 -41.62 98.12 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 115.64 -0.28 . . . . 213.66999999999999 110.768 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 28' ' ' ASP . 64.4 t -60.72 -42.77 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.18 -0.464 . . . . 275.81999999999999 111.115 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -61.39 -41.56 97.32 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.608 -0.269 . . . . 545.0 111.21 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.558 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 1.8 m-90 -74.24 -37.3 63.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.036 0.446 . . . . 999.99000000000001 110.94 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.3 tp -64.31 -41.85 96.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.945 -0.571 . . . . 205.93000000000001 112.039 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -66.18 -23.0 66.38 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.192 0.812 . . . . 557.46000000000004 113.192 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.1 m -98.21 -20.0 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 112.991 0.737 . . . . 284.56999999999999 112.991 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -109.35 -27.41 9.52 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.879 -0.328 . . . . 350.44 111.666 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.95 -26.33 60.65 Favored Glycine 0 C--N 1.331 0.265 0 CA-C-N 115.801 -0.636 . . . . 199.69999999999999 114.38 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.56 ' HG3' HG23 ' A' ' 41' ' ' THR . 12.3 ptp85 -66.4 -22.49 66.23 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.558 0.679 . . . . 999.99000000000001 111.36 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 40' ' ' ARG . 66.1 p -112.55 -20.67 11.65 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.234 0.457 . . . . 302.80000000000001 112.234 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.1 mt -73.09 147.32 45.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.122 0.487 . . . . 581.97000000000003 112.093 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -75.97 163.62 26.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 239.06999999999999 109.75 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.3 m -58.88 -42.31 89.2 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.826 0.346 . . . . 192.00999999999999 110.893 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.55 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.2 t -66.09 -42.23 91.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.311 -0.404 . . . . 278.44999999999999 110.581 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.25 -40.21 96.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.147 -0.479 . . . . 316.42000000000002 111.455 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.14 -41.99 99.39 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.661 0.267 . . . . 470.35000000000002 110.83 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.37 -39.25 85.65 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.005 0.431 . . . . 369.77999999999997 110.374 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 118' ' ' MET . . . -61.7 -36.16 80.1 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.556 -0.747 . . . . 66.790000000000006 111.105 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.78 -38.91 79.57 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.751 -0.659 . . . . 238.30000000000001 111.193 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -60.7 -40.52 92.52 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.836 0.35 . . . . 526.92999999999995 110.343 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -65.85 -40.65 91.91 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.92 -0.582 . . . . 162.88 109.968 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.82 -41.13 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 115.5 -0.773 . . . . 139.00999999999999 110.872 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -59.13 -42.73 91.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.312 -0.404 . . . . 198.61000000000001 110.598 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -65.03 -41.81 94.89 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.824 0.345 . . . . 999.99000000000001 110.519 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -63.41 -43.93 96.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.914 -0.585 . . . . 799.64999999999998 110.619 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -59.81 -48.34 82.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.704 -0.68 . . . . 151.58000000000001 111.039 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -61.16 -44.22 97.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.423 -0.353 . . . . 168.43000000000001 111.109 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.3 -43.21 99.34 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.113 0.412 . . . . 530.55999999999995 112.113 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.2 p -71.61 -41.16 69.26 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.959 -0.296 . . . . 293.49000000000001 111.571 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -63.22 -46.77 85.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.179 0.514 . . . . 383.72000000000003 110.179 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -63.83 -38.7 92.09 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.291 -0.868 . . . . 497.0 111.826 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.79 74.65 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.727 0.269 . . . . 177.0 111.727 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -60.87 -44.08 97.53 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.792 0.33 . . . . 478.75999999999999 110.302 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -70.6 -36.19 73.39 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.129 -0.487 . . . . 727.09000000000003 111.254 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 75.9 mmm -51.7 -35.22 41.93 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.065 -0.516 . . . . 664.46000000000004 112.261 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.29 -50.03 75.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.613 0.244 . . . . 447.74000000000001 111.168 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -69.45 -40.1 77.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.354 -0.385 . . . . 999.99000000000001 111.394 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.7 mm -64.78 -46.05 93.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.987 -0.551 . . . . 398.94999999999999 111.51 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.51 -43.09 99.67 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.368 -0.378 . . . . 366.97000000000003 111.23 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.59 -41.94 98.3 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.522 -0.308 . . . . 709.00999999999999 110.933 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.73 -47.1 85.02 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 931.13999999999999 110.83 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.69 -45.92 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.131 -0.486 . . . . 175.25999999999999 110.942 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.45 -45.1 94.58 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.227 -0.442 . . . . 443.19 111.684 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.66 98.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.654 -0.248 . . . . 366.44 111.594 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.4 tp -68.13 -45.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.152 0.501 . . . . 386.93000000000001 110.592 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.03 -23.02 31.27 Favored Glycine 0 C--N 1.331 0.278 0 CA-C-N 115.708 -0.678 . . . . 244.66999999999999 112.789 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -76.54 141.79 41.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.602 0.239 . . . . 999.99000000000001 110.932 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.3 p -82.0 134.41 49.71 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.579 -0.282 . . . . 263.29000000000002 110.702 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 154.95 46.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.66 2.24 . . . . 173.88999999999999 112.745 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.544 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.3 m -101.72 158.04 4.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.346 -0.388 . . . . 201.66 110.1 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.09 -45.0 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.391 -0.368 . . . . 81.090000000000003 111.97 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.459 ' O ' HG22 ' A' ' 86' ' ' THR . . . -61.26 -44.42 98.11 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.633 -0.794 . . . . 106.63 113.553 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.544 ' H ' HG23 ' A' ' 81' ' ' VAL . 33.5 t70 -71.22 -41.62 69.95 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.956 0.378 . . . . 397.23000000000002 111.491 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 19' ' ' LEU . 40.1 t80 -65.23 -39.68 93.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.094 -0.503 . . . . 176.41 111.582 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -60.46 -24.11 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.461 -0.336 . . . . 224.31999999999999 111.891 -179.604 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -62.41 -37.16 84.72 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.79 0.329 . . . . 999.99000000000001 110.887 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.67 -38.96 89.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.909 -0.587 . . . . 158.16999999999999 111.17 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.18 -39.3 96.97 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.916 -0.583 . . . . 65.709999999999994 113.101 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.09 98.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.633 0.254 . . . . 95.379999999999995 111.078 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.79 -40.09 95.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.116 -0.493 . . . . 381.13999999999999 110.85 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.5 mm -65.13 -42.71 95.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.772 -0.649 . . . . 182.12 110.953 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.54 -20.16 65.52 Favored Glycine 0 CA--C 1.52 0.388 0 CA-C-N 116.015 -0.539 . . . . 88.799999999999997 113.603 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -78.65 -24.52 45.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.037 0.418 . . . . 999.99000000000001 111.849 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.85 112.15 24.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 999.99000000000001 111.352 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.5 pt -134.69 153.47 35.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.325 -0.398 . . . . 308.67000000000002 110.757 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -147.17 55.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.053 0.454 . . . . 388.05000000000001 110.608 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.0 mtm -69.32 -28.81 66.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.78 -0.646 . . . . 360.56999999999999 111.711 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . 0.558 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -60.14 -40.16 88.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.286 -0.415 . . . . 184.22999999999999 111.717 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.15 -41.55 97.14 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.554 -0.293 . . . . 999.99000000000001 111.126 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -64.11 -43.89 93.94 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.697 -0.483 . . . . 374.13 109.697 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -60.11 -47.45 85.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.555 -0.748 . . . . 999.99000000000001 110.413 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -61.39 -40.51 94.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 558.87 110.694 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.04 96.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.094 -0.503 . . . . 332.85000000000002 111.37 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.92 -42.94 99.96 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.655 -0.248 . . . . 472.20999999999998 110.587 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -64.36 -42.99 95.92 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.029 -0.532 . . . . 821.44000000000005 110.932 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -57.97 -43.45 86.48 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.843 -0.617 . . . . 746.24000000000001 111.912 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -89.38 -4.91 57.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.547 -0.297 . . . . 999.99000000000001 111.47 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.5 t30 56.74 41.11 28.66 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.11 0.564 . . . . 675.44000000000005 111.226 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.3 mmm -108.04 101.76 10.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 999.99000000000001 111.342 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 76.1 mt -94.48 118.38 66.96 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.134 -0.485 . . . . 390.38 110.119 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.65 135.75 69.43 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.529 2.152 . . . . 243.11000000000001 112.754 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.49 143.37 28.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.202 -0.454 . . . . 618.10000000000002 110.673 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.55 ' HB2' HG13 ' A' ' 45' ' ' VAL . 27.8 t80 -68.86 108.05 3.31 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.903 0.382 . . . . 999.99000000000001 110.638 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.69 146.51 31.74 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.176 -0.465 . . . . 415.25 111.133 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -57.15 -38.38 95.61 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.886 2.391 . . . . 529.14999999999998 112.082 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -62.17 -39.43 92.67 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.64 -0.709 . . . . 516.88 110.871 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttm -58.34 -46.38 86.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.103 -0.499 . . . . 914.60000000000002 110.236 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.12 -43.67 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.448 . . . . 675.30999999999995 110.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 124' ' ' MET . 96.6 mt-10 -65.14 -42.08 94.16 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.111 0.782 . . . . 900.95000000000005 113.111 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.484 HG22 ' O ' ' A' ' 118' ' ' MET . 15.3 tt -64.64 -28.68 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 111.816 0.302 . . . . 300.73000000000002 111.816 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -63.48 -35.82 81.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.875 0.369 . . . . 595.28999999999996 111.005 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.54 -1.67 57.82 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.862 -0.608 . . . . 999.99000000000001 112.239 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 66.1 mtt -88.18 128.88 35.45 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.719 0.295 . . . . 385.68000000000001 111.573 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.529 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.5 mmt180 -53.51 142.52 40.57 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 115.939 -0.573 . . . . 999.99000000000001 110.758 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.46 -36.93 71.85 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.101 2.534 . . . . 149.59999999999999 113.283 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.17 -35.65 77.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 147.02000000000001 111.926 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -91.64 1.22 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.493 0.553 . . . . 360.37 112.493 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.4 t -90.34 113.02 55.97 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 187.93000000000001 110.965 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.67 157.25 40.04 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.812 2.341 . . . . 265.38999999999999 112.761 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.75 157.55 30.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.361 -0.381 . . . . 246.78 110.398 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -132.08 145.86 51.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.059 0.457 . . . . 999.99000000000001 111.326 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.89 168.05 15.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 495.41000000000003 111.031 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.167 -0.92 . . . . 761.34000000000003 110.949 179.945 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.65 0.262 . . . . 375.51999999999998 110.897 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.4 147.32 63.77 Favored Pre-proline 0 C--O 1.234 0.277 0 CA-C-N 116.39 -0.368 . . . . 999.99000000000001 110.55 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.82 148.35 40.91 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.763 2.308 . . . . 436.63 113.299 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -73.76 135.32 43.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.808 -0.633 . . . . 999.99000000000001 109.652 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -77.85 93.29 4.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.419 . . . . 999.99000000000001 110.793 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.68 142.41 45.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.522 -0.763 . . . . 781.60000000000002 111.831 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 64.6 t30 -66.47 132.58 48.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.784 -0.45 . . . . 216.75 109.784 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.07 -40.52 93.99 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.657 -0.247 . . . . 902.89999999999998 111.655 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.426 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -60.29 -39.82 88.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 121.34999999999999 111.521 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -73.21 -28.37 62.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.208 -0.451 . . . . 265.05000000000001 111.004 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 12' ' ' ASN . 96.4 mt-10 -63.88 -39.96 95.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.296 0.48 . . . . 524.44000000000005 112.296 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 14' ' ' ALA . 34.6 m -69.57 -34.1 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 120.674 -0.41 . . . . 214.56 111.491 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.94 95.05 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.248 0.547 . . . . 61.909999999999997 110.277 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.413 HD11 ' HA3' ' A' ' 89' ' ' GLY . 59.0 tp -69.34 -40.53 77.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.15 -0.932 . . . . 321.58999999999997 111.677 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 24' ' ' ILE . 65.0 tttm -59.74 -39.48 84.91 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.846 -0.616 . . . . 491.97000000000003 112.309 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.54 -43.7 98.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.396 0.141 . . . . 179.68000000000001 111.019 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.89 -41.53 97.69 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.721 0.296 . . . . 483.12 110.855 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.468 HG21 ' SD ' ' A' ' 58' ' ' MET . 97.1 mt -63.3 -44.55 99.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.063 -0.517 . . . . 120.91 110.873 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 20' ' ' LYS . 36.2 mm -60.68 -43.04 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 324.41000000000003 111.37 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.49 -42.84 97.14 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.8 -0.182 . . . . 76.379999999999995 111.397 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.97 -41.85 98.49 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.88 -0.676 . . . . 59.560000000000002 112.761 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -73.6 -23.8 59.97 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.885 0.328 . . . . 169.43000000000001 111.885 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -78.54 -30.17 46.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.464 -0.335 . . . . 145.09 111.427 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -62.79 -42.25 99.62 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.85 0.357 . . . . 779.76999999999998 110.83 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.96 -26.76 52.45 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.673 -0.775 . . . . 72.329999999999998 112.457 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.9 tp -65.55 -43.09 90.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.486 0.184 . . . . 213.66999999999999 111.393 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.36 -33.71 65.31 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 C-N-CA 121.015 -0.274 . . . . 275.81999999999999 111.336 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.62 -40.61 95.79 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 121.334 0.588 . . . . 545.0 109.701 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -64.91 -41.75 95.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.168 -0.923 . . . . 999.99000000000001 109.588 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.86 -37.04 83.01 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.228 -0.896 . . . . 205.93000000000001 111.146 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -62.43 -37.13 84.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.615 0.245 . . . . 557.46000000000004 111.42 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.86 -50.06 14.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 113.424 0.898 . . . . 284.56999999999999 113.424 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -107.51 -29.74 9.03 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -69.19 -13.01 66.65 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.093 -0.575 . . . . 199.69999999999999 113.82 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.437 ' HG3' HG23 ' A' ' 41' ' ' THR . 40.8 ptt180 -64.09 -22.04 66.77 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.87 0.335 . . . . 999.99000000000001 111.708 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.437 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.0 p -105.88 -15.35 14.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.953 0.406 . . . . 302.80000000000001 111.525 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -73.63 148.76 42.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 581.97000000000003 111.546 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -76.97 167.21 22.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.995 -0.548 . . . . 239.06999999999999 110.57 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -64.7 -32.07 73.58 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.987 0.366 . . . . 192.00999999999999 111.987 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.427 HG12 ' HB3' ' A' ' 114' ' ' TYR . 0.4 OUTLIER -69.03 -39.77 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.958 0.408 . . . . 278.44999999999999 110.198 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.545 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 90.1 mt-30 -64.99 -41.32 95.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.829 -0.623 . . . . 316.42000000000002 110.879 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.27 -45.33 92.0 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.078 -0.51 . . . . 470.35000000000002 110.785 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.27 -38.45 91.08 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.716 -0.675 . . . . 369.77999999999997 110.823 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.02 85.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.887 -0.597 . . . . 66.790000000000006 111.528 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.411 ' HA ' HG22 ' A' ' 53' ' ' VAL . 88.2 mt -62.24 -38.18 88.25 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.414 -0.357 . . . . 238.30000000000001 111.558 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -63.05 -39.01 93.45 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.306 -0.627 . . . . 526.92999999999995 109.306 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -62.12 -48.06 81.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.344 -0.844 . . . . 162.88 111.608 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.425 HG21 ' CE2' ' A' ' 101' ' ' PHE . 17.2 m -68.89 -24.16 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 C-N-CA 121.016 -0.273 . . . . 139.00999999999999 111.679 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.88 -41.37 91.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.53 -0.304 . . . . 198.61000000000001 110.569 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -62.96 -41.92 99.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.491 -0.322 . . . . 999.99000000000001 110.448 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -63.93 -44.03 94.1 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.166 0.507 . . . . 799.64999999999998 110.036 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -60.13 -47.47 85.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.226 -0.897 . . . . 151.58000000000001 111.113 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.468 ' SD ' HG21 ' A' ' 23' ' ' ILE . 47.0 ttp -59.33 -45.46 91.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.995 -0.548 . . . . 168.43000000000001 111.068 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.658 ' HG2' HG13 ' A' ' 131' ' ' VAL . 56.5 mt-30 -64.7 -41.47 95.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.476 -0.329 . . . . 530.55999999999995 111.139 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -66.09 -45.5 80.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.22 -0.446 . . . . 293.49000000000001 110.787 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -64.38 -42.36 96.19 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.036 -0.529 . . . . 383.72000000000003 110.548 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.43 ' HB2' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -60.11 -41.38 92.44 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.607 -0.724 . . . . 497.0 111.827 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.07 91.26 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.378 0.51 . . . . 177.0 112.378 -178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -62.55 -47.84 82.12 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.984 0.421 . . . . 478.75999999999999 111.014 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.418 ' HE2' HD22 ' A' ' 88' ' ' LEU . 55.7 t80 -68.46 -44.35 75.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.916 -0.584 . . . . 727.09000000000003 111.188 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 62' ' ' TRP . 0.0 OUTLIER -52.18 -39.11 59.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.566 -0.743 . . . . 664.46000000000004 112.893 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.39 -41.62 94.19 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.885 0.328 . . . . 447.74000000000001 111.885 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -68.09 -40.47 82.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.977 0.418 . . . . 999.99000000000001 110.69 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.429 ' O ' HG12 ' A' ' 73' ' ' ILE . 48.7 mm -70.62 -41.25 77.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.709 -0.678 . . . . 398.94999999999999 111.293 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -58.94 -40.95 86.2 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.033 -0.53 . . . . 366.97000000000003 111.694 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.91 -43.5 98.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.859 0.361 . . . . 709.00999999999999 110.541 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -66.58 -44.92 80.92 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.817 -0.629 . . . . 931.13999999999999 110.938 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.2 mm -64.38 -45.01 97.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 115.831 -0.622 . . . . 175.25999999999999 111.452 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -61.02 -43.79 98.36 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.309 -0.405 . . . . 443.19 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.21 -40.35 97.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.392 -0.367 . . . . 366.44 111.445 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -70.28 -40.54 74.27 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.422 -0.354 . . . . 386.93000000000001 111.486 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.63 -8.0 80.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.962 -0.637 . . . . 244.66999999999999 112.688 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -74.64 148.82 40.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 999.99000000000001 111.588 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.6 p -103.77 106.24 51.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 263.29000000000002 110.94 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 33.0 Cg_exo -60.91 143.88 99.45 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.138 2.559 . . . . 173.88999999999999 113.348 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -100.49 -175.78 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 201.66 110.996 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.39 -42.9 89.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-N 116.414 -0.357 . . . . 81.090000000000003 110.856 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.536 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -40.43 98.18 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.825 -0.702 . . . . 106.63 112.506 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -64.19 -42.26 96.75 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.851 0.357 . . . . 397.23000000000002 110.835 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 48.2 m-85 -71.16 -35.8 71.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.061 -0.518 . . . . 176.41 111.644 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.536 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -62.43 -35.93 80.8 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.575 0.226 . . . . 224.31999999999999 110.779 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -63.56 -45.03 92.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.248 0.547 . . . . 999.99000000000001 109.98 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.418 HD22 ' HE2' ' A' ' 65' ' ' TYR . 98.0 mt -65.82 -40.66 92.03 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.47 -0.786 . . . . 158.16999999999999 110.483 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.413 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.87 -39.48 98.07 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 115.687 -0.688 . . . . 65.709999999999994 112.779 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.7 90.07 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.631 0.253 . . . . 95.379999999999995 111.198 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.83 -41.84 97.76 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.27 -0.423 . . . . 381.13999999999999 110.421 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.89 -42.26 91.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.744 -0.662 . . . . 182.12 111.171 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.49 -9.16 64.3 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.928 -0.578 . . . . 88.799999999999997 113.691 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.31 -30.4 54.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.906 0.384 . . . . 999.99000000000001 110.86 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -100.89 120.63 40.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 999.99000000000001 110.421 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 80.9 mt -116.48 119.72 62.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.528 -0.306 . . . . 308.67000000000002 110.773 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -110.97 24.66 12.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.299 -0.409 . . . . 388.05000000000001 111.946 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.7 mmm -61.71 -39.1 90.32 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.602 0.239 . . . . 360.56999999999999 111.28 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -39.25 90.13 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.035 0.445 . . . . 184.22999999999999 110.798 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -66.05 -35.98 82.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.668 -0.696 . . . . 999.99000000000001 111.026 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.425 ' CE2' HG21 ' A' ' 53' ' ' VAL . 87.5 t80 -58.9 -48.95 79.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.329 -0.396 . . . . 374.13 110.514 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -61.01 -47.8 84.74 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.922 -0.581 . . . . 999.99000000000001 110.798 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.56 -39.62 91.77 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.8 -0.636 . . . . 558.87 111.776 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.26 98.49 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.551 -0.295 . . . . 332.85000000000002 111.393 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 91.0 mt -64.79 -40.81 95.85 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.384 -0.371 . . . . 472.20999999999998 110.722 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.43 -43.68 96.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.892 -0.595 . . . . 821.44000000000005 111.096 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.85 -40.12 83.31 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.122 -0.49 . . . . 746.24000000000001 112.023 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -89.01 -7.24 56.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.587 -0.279 . . . . 999.99000000000001 111.287 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 52.9 t30 58.43 32.41 22.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.826 -0.625 . . . . 675.44000000000005 111.258 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 22.4 mmt -107.31 98.5 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 999.99000000000001 111.063 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.0 mt -94.24 119.67 66.3 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.022 -0.535 . . . . 390.38 110.514 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.36 150.85 65.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.454 2.102 . . . . 243.11000000000001 112.163 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -84.8 118.31 24.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.842 0.353 . . . . 618.10000000000002 110.56 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.545 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 23.7 m-85 -70.33 107.71 3.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.84 -0.618 . . . . 999.99000000000001 111.043 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.72 143.5 26.33 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.605 -0.271 . . . . 415.25 111.264 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -58.25 -35.07 99.07 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.071 2.514 . . . . 529.14999999999998 112.933 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -63.02 -34.18 77.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.25 -0.432 . . . . 516.88 111.027 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 95.8 mtp -60.17 -40.07 88.64 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.884 0.373 . . . . 914.60000000000002 110.129 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.03 -39.9 93.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.755 -0.657 . . . . 675.30999999999995 110.183 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 124' ' ' MET . 88.5 tt0 -62.92 -41.68 99.55 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.608 -0.723 . . . . 900.95000000000005 111.146 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.56 -42.37 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.813 0.34 . . . . 300.73000000000002 110.724 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.87 -38.57 82.54 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.08 -0.509 . . . . 595.28999999999996 111.129 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -77.71 -9.66 59.11 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.336 0.495 . . . . 999.99000000000001 112.336 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 68.1 mtt -71.54 139.22 49.39 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.653 0.264 . . . . 385.68000000000001 111.107 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -52.33 136.13 41.14 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.904 -0.589 . . . . 999.99000000000001 111.263 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -54.31 -36.88 88.13 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.039 2.493 . . . . 149.59999999999999 113.079 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.411 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -64.3 -25.48 68.07 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.3 -0.409 . . . . 147.02000000000001 111.851 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -92.03 -1.77 57.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.455 -0.339 . . . . 360.37 111.383 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 60.1 t -99.94 112.98 64.93 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.669 -0.241 . . . . 187.93000000000001 110.745 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.23 152.58 61.73 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.501 2.134 . . . . 265.38999999999999 112.347 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.658 HG13 ' HG2' ' A' ' 59' ' ' GLN . 96.7 t -124.38 135.8 62.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 246.78 110.275 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -133.28 134.71 44.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.385 -0.371 . . . . 999.99000000000001 110.419 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -84.74 92.46 8.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.981 0.42 . . . . 495.41000000000003 110.371 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.282 -0.866 . . . . 761.34000000000003 111.345 -179.706 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.478 ' HB ' ' OD1' ' A' ' 70' ' ' ASN . 73.1 t . . . . . 0 C--O 1.232 0.177 0 N-CA-C 109.852 -0.425 . . . . 375.51999999999998 109.852 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -81.36 125.15 79.67 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.597 -0.274 . . . . 999.99000000000001 110.826 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.72 151.73 63.81 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.698 2.265 . . . . 436.63 112.788 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -132.76 134.89 45.31 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 999.99000000000001 109.722 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 63.81 33.67 12.55 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.582 0.551 . . . . 999.99000000000001 111.49 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -56.26 120.45 7.61 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.257 -0.429 . . . . 781.60000000000002 110.953 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -91.48 106.49 18.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.43 -0.35 . . . . 216.75 111.055 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.32 -22.11 66.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.93 -0.577 . . . . 902.89999999999998 111.819 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.44 81.43 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.804 0.335 . . . . 121.34999999999999 111.488 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -63.4 -37.29 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 265.05000000000001 109.98 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.76 -39.37 93.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.745 -0.661 . . . . 524.44000000000005 110.419 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.59 -46.92 95.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.812 -0.631 . . . . 214.56 111.285 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.01 99.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.22 -0.445 . . . . 61.909999999999997 111.256 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 85' ' ' TYR . 91.0 mt -67.21 -37.98 84.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.838 -0.619 . . . . 321.58999999999997 111.306 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.15 -39.7 83.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.736 -0.665 . . . . 491.97000000000003 111.586 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 74.1 t -62.82 -44.26 99.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.606 0.241 . . . . 179.68000000000001 110.657 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.82 -40.22 91.63 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.939 0.4 . . . . 483.12 110.744 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.07 -41.98 94.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.748 -0.66 . . . . 120.91 111.317 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.5 mt -60.05 -43.15 92.05 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.49 -0.323 . . . . 324.41000000000003 111.193 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -43.98 97.36 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.598 0.237 . . . . 76.379999999999995 111.228 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.48 -40.18 96.08 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.068 -0.587 . . . . 59.560000000000002 112.495 178.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -72.78 -20.49 61.16 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.384 0.273 . . . . 169.43000000000001 111.489 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.37 -36.42 60.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.535 -0.302 . . . . 145.09 110.557 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -60.84 -44.12 97.4 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.329 -0.619 . . . . 779.76999999999998 109.329 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.63 -39.07 97.43 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.475 -0.784 . . . . 72.329999999999998 112.215 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 83.2 mt -62.14 -40.51 96.19 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.458 0.171 . . . . 213.66999999999999 111.058 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.4 t -60.96 -43.97 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.191 -0.459 . . . . 275.81999999999999 110.702 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.72 -44.6 96.42 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.147 -0.479 . . . . 545.0 111.02 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -68.03 -38.42 82.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.925 0.393 . . . . 999.99000000000001 110.179 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.6 mt -62.17 -37.0 83.56 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.929 -0.578 . . . . 205.93000000000001 111.611 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -61.87 -37.12 83.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.601 0.238 . . . . 557.46000000000004 111.543 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.5 t -87.82 -52.5 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 113.502 0.926 . . . . 284.56999999999999 113.502 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -115.36 -5.74 12.32 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.244 0.831 . . . . 350.44 113.244 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.94 -37.86 93.27 Favored Glycine 0 N--CA 1.46 0.282 0 C-N-CA 121.29 -0.481 . . . . 199.69999999999999 113.685 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.405 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.8 ptm180 -62.01 -18.66 61.26 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.265 0.468 . . . . 999.99000000000001 112.265 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.405 HG23 ' HG3' ' A' ' 40' ' ' ARG . 73.5 p -106.15 1.07 25.9 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.409 0.522 . . . . 302.80000000000001 112.409 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.424 HD12 ' HA2' ' A' ' 39' ' ' GLY . 86.8 mt -72.27 141.22 48.91 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.0 0.429 . . . . 581.97000000000003 111.962 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.0 m -77.78 162.77 26.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.746 -0.661 . . . . 239.06999999999999 110.495 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.9 m -60.02 -42.39 94.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.818 0.342 . . . . 192.00999999999999 110.96 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.617 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.7 t -65.89 -41.96 91.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.125 -0.488 . . . . 278.44999999999999 110.799 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.15 -40.91 98.94 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.21 -0.45 . . . . 316.42000000000002 111.178 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 64.2 tttm -61.47 -45.7 93.13 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.386 -0.37 . . . . 470.35000000000002 110.924 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.03 -38.72 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 369.77999999999997 111.019 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.21 -22.94 66.34 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.729 -0.668 . . . . 66.790000000000006 112.433 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -53.85 -36.27 62.4 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.384 0.512 . . . . 238.30000000000001 112.384 -179.303 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -62.41 -41.21 98.51 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.796 0.331 . . . . 526.92999999999995 110.785 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -70.43 -37.61 74.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 162.88 110.22 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.34 -41.22 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.669 -0.696 . . . . 139.00999999999999 111.014 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.44 HD21 HD11 ' A' ' 31' ' ' LEU . 38.8 m-80 -59.99 -39.79 86.96 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.778 -0.192 . . . . 198.61000000000001 110.943 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -61.62 -46.15 91.04 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.789 0.328 . . . . 999.99000000000001 110.235 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -63.28 -41.72 99.03 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.979 -0.555 . . . . 799.64999999999998 110.61 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -61.77 -41.52 97.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.568 -0.742 . . . . 151.58000000000001 110.036 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 98.2 mtp -64.97 -38.55 91.32 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.961 -0.563 . . . . 168.43000000000001 111.364 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.03 -40.9 95.36 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.833 0.679 . . . . 530.55999999999995 112.833 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.471 ' HA ' ' SD ' ' A' ' 134' ' ' MET . 75.8 p -68.46 -38.85 81.48 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.694 -0.402 . . . . 293.49000000000001 111.371 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.474 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 69.9 m80 -70.7 -40.13 73.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.351 -0.386 . . . . 383.72000000000003 111.206 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.423 ' HH2' HD13 ' A' ' 19' ' ' LEU . 30.7 m95 -63.85 -39.84 95.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 497.0 112.206 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.73 90.65 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.828 0.307 . . . . 177.0 111.828 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -65.04 -46.86 79.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.828 0.347 . . . . 478.75999999999999 111.486 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.492 ' O ' HG12 ' A' ' 69' ' ' ILE . 62.7 m-85 -70.54 -40.52 73.35 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.346 -0.388 . . . . 727.09000000000003 112.025 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 17.7 tpt -53.76 -50.13 66.71 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.184 0.438 . . . . 664.46000000000004 112.184 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.95 -39.96 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.957 0.354 . . . . 447.74000000000001 111.957 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -61.99 -47.88 82.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 999.99000000000001 111.67 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.7 pt -80.11 -24.63 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.43 0.53 . . . . 398.94999999999999 112.43 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.478 ' OD1' ' HB ' ' A' ' 6' ' ' VAL . 28.6 t-20 -58.73 -45.52 89.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.613 0.227 . . . . 366.97000000000003 111.613 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.23 -41.73 96.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.548 -0.296 . . . . 709.00999999999999 111.237 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -70.06 -42.7 72.51 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.135 0.42 . . . . 931.13999999999999 112.135 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.83 -46.62 95.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.578 0.228 . . . . 175.25999999999999 111.433 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.58 -46.89 86.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.465 -0.334 . . . . 443.19 111.757 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.51 -41.16 96.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.171 0.434 . . . . 366.44 112.171 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.13 -40.6 71.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.875 0.369 . . . . 386.93000000000001 111.594 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.1 -8.23 78.93 Favored Glycine 0 CA--C 1.52 0.36 0 C-N-CA 121.042 -0.599 . . . . 244.66999999999999 112.287 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.8 mmt-85 -75.22 150.65 38.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.944 0.402 . . . . 999.99000000000001 111.546 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 p -107.42 100.98 36.86 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 263.29000000000002 110.634 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.516 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 46.0 Cg_exo -59.51 140.98 96.58 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.022 2.481 . . . . 173.88999999999999 113.398 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.29 -175.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.766 -0.652 . . . . 201.66 111.115 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.6 t -59.31 -41.6 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 116.375 -0.375 . . . . 81.090000000000003 110.909 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.577 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.38 -40.68 97.88 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.815 -0.707 . . . . 106.63 112.536 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -70.1 -42.29 72.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.018 0.437 . . . . 397.23000000000002 110.803 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.723 ' HB3' HD11 ' A' ' 19' ' ' LEU . 26.5 m-85 -68.0 -34.13 75.94 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.809 -0.632 . . . . 176.41 112.687 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -56.03 -32.57 64.13 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.686 0.254 . . . . 224.31999999999999 111.686 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -62.48 -45.42 93.11 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.05 0.453 . . . . 999.99000000000001 109.982 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.3 mt -66.12 -40.78 90.94 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.695 -0.684 . . . . 158.16999999999999 110.559 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.53 -40.64 99.37 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.661 -0.699 . . . . 65.709999999999994 112.364 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.91 -40.01 94.0 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.521 0.201 . . . . 95.379999999999995 110.836 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -63.44 -40.12 96.31 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.213 -0.449 . . . . 381.13999999999999 110.567 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.73 -42.69 96.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.996 -0.547 . . . . 182.12 110.517 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.33 -10.44 66.12 Favored Glycine 0 CA--C 1.522 0.488 0 CA-C-N 115.689 -0.687 . . . . 88.799999999999997 113.747 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.1 mmm180 -79.85 -13.92 59.05 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 117.107 0.454 . . . . 999.99000000000001 111.332 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -97.3 114.33 26.08 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.714 -0.476 . . . . 999.99000000000001 109.714 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.2 pt -121.8 23.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.325 -0.398 . . . . 308.67000000000002 111.817 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -81.64 77.94 8.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 388.05000000000001 111.034 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 67.4 mtt -91.75 -2.65 56.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.059 -0.519 . . . . 360.56999999999999 110.817 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.31 -37.3 82.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.819 -0.628 . . . . 184.22999999999999 110.898 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -58.64 -44.94 90.23 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.472 -0.785 . . . . 999.99000000000001 111.205 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.67 -48.3 77.91 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.443 -0.344 . . . . 374.13 111.285 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -65.0 -39.84 94.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 999.99000000000001 111.051 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.34 -41.8 98.9 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.064 -0.516 . . . . 558.87 110.69 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.82 92.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.929 -0.578 . . . . 332.85000000000002 111.466 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.0 -42.07 99.75 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.43 -0.35 . . . . 472.20999999999998 110.862 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -63.72 -39.52 94.51 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 116.339 -0.392 . . . . 821.44000000000005 110.953 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.84 -39.8 82.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.063 -0.517 . . . . 746.24000000000001 111.545 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -84.56 -11.91 55.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.45 -0.341 . . . . 999.99000000000001 111.344 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.9 t30 54.38 42.96 31.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.953 -0.567 . . . . 675.44000000000005 111.524 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 63.3 tpp -127.87 118.64 24.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 999.99000000000001 111.107 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.0 mt -94.82 119.04 66.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 390.38 110.085 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.27 140.48 37.22 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.243 1.962 . . . . 243.11000000000001 112.83 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -85.88 150.39 24.56 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.063 -0.517 . . . . 618.10000000000002 110.846 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.617 ' HB2' HG13 ' A' ' 45' ' ' VAL . 50.5 t80 -67.61 125.27 25.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.784 0.326 . . . . 999.99000000000001 110.483 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.8 mt -98.96 145.61 30.26 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 415.25 111.336 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.86 -24.43 53.84 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.637 2.225 . . . . 529.14999999999998 111.97 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.85 -34.92 78.35 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.502 -0.772 . . . . 516.88 110.915 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.9 mtt -59.95 -39.5 85.78 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.091 -0.504 . . . . 914.60000000000002 110.483 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -61.44 -41.59 97.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.104 -0.498 . . . . 675.30999999999995 110.674 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -64.78 -42.18 95.28 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.074 -0.512 . . . . 900.95000000000005 110.828 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.8 mm -62.02 -46.65 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.088 -0.505 . . . . 300.73000000000002 111.07 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.5 -41.93 96.13 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.138 -0.483 . . . . 595.28999999999996 112.189 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -65.1 -35.81 82.31 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.448 0.536 . . . . 999.99000000000001 112.448 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.4 mtm -90.73 134.5 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.036 0.384 . . . . 385.68000000000001 112.036 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -53.09 146.13 21.41 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.668 -0.696 . . . . 999.99000000000001 111.755 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.24 -37.54 88.11 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.028 2.485 . . . . 149.59999999999999 112.949 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.77 -19.76 61.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.289 -0.414 . . . . 147.02000000000001 112.072 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -91.59 -21.67 20.71 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.185 0.439 . . . . 360.37 112.185 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.4 m -90.65 146.71 34.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.848 0.356 . . . . 187.93000000000001 111.306 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.53 156.73 53.75 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.702 2.268 . . . . 265.38999999999999 112.952 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.8 t -115.87 137.08 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.34 -0.615 . . . . 246.78 109.34 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -144.59 140.88 29.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.603 -0.271 . . . . 999.99000000000001 110.573 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -82.83 175.59 9.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.085 -0.507 . . . . 495.41000000000003 110.302 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.471 ' SD ' ' HA ' ' A' ' 60' ' ' THR . 27.9 ptm . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.3 -0.857 . . . . 761.34000000000003 110.961 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 71.3 t . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.629 0.252 . . . . 375.51999999999998 110.354 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -82.46 147.44 56.25 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.477 -0.329 . . . . 999.99000000000001 110.901 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.71 152.41 47.66 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.73 2.287 . . . . 436.63 112.861 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -88.95 61.27 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.458 -0.337 . . . . 999.99000000000001 111.457 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 54.94 47.74 21.52 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.783 -0.644 . . . . 999.99000000000001 112.237 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.8 mt -56.68 142.27 40.68 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.322 -0.399 . . . . 781.60000000000002 111.064 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.37 114.06 19.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 216.75 111.102 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -64.12 -24.11 67.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.81 -0.632 . . . . 902.89999999999998 111.999 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.91 -39.16 84.48 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.885 0.374 . . . . 121.34999999999999 111.182 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -65.35 -34.88 79.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 265.05000000000001 109.965 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -64.15 -40.12 95.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.567 -0.742 . . . . 524.44000000000005 110.1 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.06 -46.87 95.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.774 -0.648 . . . . 214.56 111.186 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.04 -41.6 98.29 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.0 -0.546 . . . . 61.909999999999997 111.059 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 85' ' ' TYR . 62.4 tp -67.98 -41.03 82.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 321.58999999999997 111.428 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.98 -40.48 84.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.95 -0.568 . . . . 491.97000000000003 111.78 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.21 -43.78 98.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.726 0.298 . . . . 179.68000000000001 110.535 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.66 -39.12 91.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.393 . . . . 483.12 110.947 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.48 -42.37 95.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.153 -0.476 . . . . 120.91 110.603 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 91.9 mt -60.06 -41.14 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.693 -0.685 . . . . 324.41000000000003 111.642 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.51 -43.29 93.43 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.724 0.268 . . . . 76.379999999999995 111.724 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.44 -41.82 97.85 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.684 -0.77 . . . . 59.560000000000002 112.515 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -74.26 -18.29 60.75 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.963 0.357 . . . . 169.43000000000001 111.963 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.422 ' HA ' HD12 ' A' ' 31' ' ' LEU . 34.0 t70 -75.79 -31.49 59.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.401 -0.363 . . . . 145.09 110.908 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -62.8 -39.71 95.08 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.366 -0.605 . . . . 779.76999999999998 109.366 178.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.65 -35.78 91.69 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.376 -0.829 . . . . 72.329999999999998 112.409 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 54' ' ' ASN . 77.0 mt -61.88 -42.77 99.46 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.078 0.399 . . . . 213.66999999999999 112.078 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 33.5 m -74.23 -32.2 31.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 C-N-CA 120.651 -0.42 . . . . 275.81999999999999 111.298 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.09 -40.64 94.88 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.919 0.39 . . . . 545.0 110.576 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.522 ' HZ3' HD22 ' A' ' 42' ' ' LEU . 59.0 t90 -66.44 -39.5 88.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.031 -0.532 . . . . 999.99000000000001 109.582 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.13 -37.04 83.65 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.561 -0.745 . . . . 205.93000000000001 111.071 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.18 -36.66 84.36 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.644 0.259 . . . . 557.46000000000004 111.464 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.04 -51.62 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 113.599 0.963 . . . . 284.56999999999999 113.599 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -108.55 -4.67 17.01 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.274 0.842 . . . . 350.44 113.274 -177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.28 -12.23 72.28 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.125 -0.559 . . . . 199.69999999999999 113.95 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -61.18 -40.22 93.09 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.818 0.309 . . . . 999.99000000000001 111.339 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.8 p -112.36 8.7 19.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.517 -0.31 . . . . 302.80000000000001 111.796 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 ' HZ3' ' A' ' 34' ' ' TRP . 30.0 tp -71.46 131.69 43.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.373 -0.376 . . . . 581.97000000000003 111.32 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.0 t -70.54 152.34 44.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.136 -0.483 . . . . 239.06999999999999 110.732 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.7 m -59.88 -41.48 91.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.184 -0.462 . . . . 192.00999999999999 111.367 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 45' ' ' VAL . 2.1 t -68.76 -37.35 77.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.885 0.374 . . . . 278.44999999999999 110.464 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.43 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 97.5 mt-30 -64.13 -38.28 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.973 -0.558 . . . . 316.42000000000002 111.073 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.04 -45.11 93.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 470.35000000000002 110.682 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -63.47 -40.4 97.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.003 0.43 . . . . 369.77999999999997 110.408 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.07 91.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.705 -0.68 . . . . 66.790000000000006 111.338 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.95 -44.13 94.58 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.932 -0.576 . . . . 238.30000000000001 111.78 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -62.21 -40.25 95.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 526.92999999999995 110.288 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -62.72 -44.78 95.35 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.129 -0.487 . . . . 162.88 110.012 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 56.7 t -60.36 -40.43 83.96 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 CA-C-N 115.903 -0.589 . . . . 139.00999999999999 110.097 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB2' HD21 ' A' ' 31' ' ' LEU . 28.9 t-20 -58.93 -45.34 90.63 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.387 -0.37 . . . . 198.61000000000001 110.714 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -64.27 -42.46 96.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.762 0.315 . . . . 999.99000000000001 110.859 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -63.85 -44.71 92.35 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.234 0.54 . . . . 799.64999999999998 110.099 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -60.71 -46.95 88.43 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.249 -0.887 . . . . 151.58000000000001 110.936 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.9 ttp -59.45 -44.59 92.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.181 -0.463 . . . . 168.43000000000001 110.955 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -64.33 -42.23 96.39 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.882 0.372 . . . . 530.55999999999995 110.731 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.1 m -64.72 -44.89 88.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.886 -0.597 . . . . 293.49000000000001 110.772 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -63.96 -44.92 91.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.783 -0.644 . . . . 383.72000000000003 110.268 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -62.06 -45.1 95.05 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.65 -0.704 . . . . 497.0 111.713 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.45 79.66 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.396 0.517 . . . . 177.0 112.396 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -61.07 -48.54 81.27 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.643 0.259 . . . . 478.75999999999999 110.85 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -71.63 -39.02 70.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.413 . . . . 727.09000000000003 111.612 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 28.1 ttt -52.16 -46.27 65.41 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.551 0.575 . . . . 664.46000000000004 112.551 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.66 -42.14 96.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.713 -0.221 . . . . 447.74000000000001 111.331 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -68.67 -40.14 80.28 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.977 0.418 . . . . 999.99000000000001 110.492 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.3 -44.13 98.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 115.6 -0.727 . . . . 398.94999999999999 110.496 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.85 -41.49 91.56 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.06 -0.518 . . . . 366.97000000000003 111.2 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.99 -42.33 99.02 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.53 -0.305 . . . . 709.00999999999999 110.682 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.9 -41.59 91.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.148 -0.478 . . . . 931.13999999999999 110.808 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.541 HD13 ' HG3' ' A' ' 80' ' ' PRO . 95.0 mt -62.67 -46.23 96.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.911 -0.586 . . . . 175.25999999999999 110.663 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -61.59 -45.09 95.6 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.99 -0.55 . . . . 443.19 111.508 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.23 -41.01 99.05 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.47 -0.332 . . . . 366.44 111.764 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.94 -41.01 71.69 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.027 0.442 . . . . 386.93000000000001 111.345 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.33 -11.1 70.81 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.875 -0.602 . . . . 244.66999999999999 112.504 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.6 mpt_? -75.64 145.7 40.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.782 0.325 . . . . 999.99000000000001 111.432 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.0 t -91.6 116.53 66.63 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 121.009 0.433 . . . . 263.29000000000002 110.567 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.541 ' HG3' HD13 ' A' ' 73' ' ' ILE . 69.6 Cg_endo -72.66 145.12 40.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.617 2.212 . . . . 173.88999999999999 113.304 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 m -102.07 178.47 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 201.66 110.849 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.0 t -60.83 -42.53 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.241 -0.436 . . . . 81.090000000000003 110.517 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.28 -39.58 96.24 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 121.107 -0.568 . . . . 106.63 112.777 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.91 -40.58 95.95 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.023 0.439 . . . . 397.23000000000002 110.259 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD22 ' A' ' 19' ' ' LEU . 36.5 m-85 -67.44 -39.08 85.4 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.617 -0.719 . . . . 176.41 111.763 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.6 p -65.81 -34.81 79.03 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 111.9 0.333 . . . . 224.31999999999999 111.9 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -64.79 -41.54 95.76 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.005 0.431 . . . . 999.99000000000001 110.172 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -69.88 -40.5 75.65 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.698 -0.683 . . . . 158.16999999999999 110.623 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.8 -39.86 98.51 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.599 -0.728 . . . . 65.709999999999994 113.004 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.21 96.28 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.662 0.267 . . . . 95.379999999999995 111.135 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.67 -40.82 97.8 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.262 -0.426 . . . . 381.13999999999999 110.674 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.45 -42.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.811 -0.631 . . . . 182.12 110.865 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.95 -16.85 62.4 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.933 -0.576 . . . . 88.799999999999997 113.542 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -79.85 -13.82 59.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.864 0.332 . . . . 999.99000000000001 111.227 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -108.22 114.71 28.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 999.99000000000001 110.584 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.403 HG22 ' H ' ' A' ' 98' ' ' MET . 75.6 mt -125.52 118.59 52.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 308.67000000000002 110.471 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -106.02 19.27 20.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.544 -0.298 . . . . 388.05000000000001 111.789 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.41 ' O ' ' HB3' ' A' ' 101' ' ' PHE . 98.0 mtp -62.29 -38.3 88.83 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.04 0.385 . . . . 360.56999999999999 112.04 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.1 -39.59 90.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.096 0.474 . . . . 184.22999999999999 110.551 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.75 -24.48 59.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.666 -0.697 . . . . 999.99000000000001 111.269 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 98' ' ' MET . 86.8 t80 -58.16 -48.71 79.45 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.14 -0.482 . . . . 374.13 110.995 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.09 -39.46 94.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.393 -0.367 . . . . 999.99000000000001 111.005 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.92 -44.9 95.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.195 -0.457 . . . . 558.87 110.903 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.76 -41.23 99.13 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.104 -0.498 . . . . 332.85000000000002 111.319 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.99 -45.12 86.92 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.159 -0.473 . . . . 472.20999999999998 111.258 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -64.61 -39.82 94.41 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.482 -0.326 . . . . 821.44000000000005 111.269 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.06 -43.89 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.162 -0.472 . . . . 746.24000000000001 111.99 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -91.38 -3.76 56.4 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.412 -0.358 . . . . 999.99000000000001 111.317 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.4 t30 57.53 37.44 27.66 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.235 0.614 . . . . 675.44000000000005 111.139 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 38.6 mmt -105.8 83.57 1.94 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.982 -0.554 . . . . 999.99000000000001 110.675 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.51 116.67 66.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.458 -0.337 . . . . 390.38 110.789 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.37 157.68 45.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.728 2.285 . . . . 243.11000000000001 112.651 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -80.12 126.27 30.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.464 -0.335 . . . . 618.10000000000002 110.348 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 16.1 m-85 -70.03 90.96 0.66 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 999.99000000000001 111.33 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.7 145.31 29.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.485 -0.325 . . . . 415.25 110.477 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -79.51 45.3 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.493 2.129 . . . . 529.14999999999998 113.009 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -70.58 -29.22 65.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 516.88 110.393 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . 0.4 ' HA ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttp -58.7 -43.31 90.02 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.608 -0.724 . . . . 914.60000000000002 111.113 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -61.11 -41.44 96.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.536 -0.302 . . . . 675.30999999999995 110.621 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.96 -41.22 82.78 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.011 -0.541 . . . . 900.95000000000005 111.911 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.4 HG22 ' HA ' ' A' ' 118' ' ' MET . 7.7 tp -73.52 -28.32 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 111.707 0.262 . . . . 300.73000000000002 111.707 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -70.21 -17.43 63.14 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.614 -0.266 . . . . 595.28999999999996 111.698 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -65.04 -33.13 75.3 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.467 -0.333 . . . . 999.99000000000001 111.614 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.4 mtm -95.47 134.63 38.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.643 -0.253 . . . . 385.68000000000001 111.174 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.0 mtt-85 -52.53 139.34 39.0 Favored Pre-proline 0 N--CA 1.465 0.281 0 CA-C-N 116.203 -0.453 . . . . 999.99000000000001 110.851 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -60.22 -26.09 81.71 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.869 2.379 . . . . 149.59999999999999 113.274 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.71 -36.8 81.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 147.02000000000001 111.647 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -92.19 -1.2 57.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.389 -0.368 . . . . 360.37 111.961 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.5 t -87.15 120.5 71.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.684 0.278 . . . . 187.93000000000001 110.711 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.83 158.4 55.65 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.512 2.142 . . . . 265.38999999999999 112.311 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 88.0 t -106.0 137.59 35.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.207 -0.452 . . . . 246.78 110.109 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -78.93 116.56 19.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.023 0.44 . . . . 999.99000000000001 110.951 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -84.18 153.28 23.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.83 -0.623 . . . . 495.41000000000003 110.623 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.154 -0.927 . . . . 761.34000000000003 110.908 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.231 0.126 0 CA-C-O 121.02 0.438 . . . . 375.51999999999998 111.116 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.87 150.67 66.1 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.985 -0.552 . . . . 999.99000000000001 110.482 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.467 ' HA ' ' OD2' ' A' ' 74' ' ' ASP . 50.5 Cg_endo -68.38 138.2 41.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.268 1.979 . . . . 436.63 112.687 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -102.59 -9.3 20.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.009 -0.542 . . . . 999.99000000000001 110.639 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -107.22 9.14 30.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 999.99000000000001 111.104 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -57.13 125.92 24.87 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.987 -0.551 . . . . 781.60000000000002 111.104 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -108.53 113.94 27.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.507 -0.315 . . . . 216.75 110.38 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 58.3 mtmt -62.48 -39.18 92.64 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.101 -0.5 . . . . 902.89999999999998 111.782 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.72 85.8 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.936 0.398 . . . . 121.34999999999999 111.54 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -71.34 -29.31 64.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.24 -0.437 . . . . 265.05000000000001 110.72 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.416 ' OE1' ' HA ' ' A' ' 13' ' ' LYS . 54.3 mt-10 -64.62 -40.72 95.99 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.899 -0.592 . . . . 524.44000000000005 112.115 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 127' ' ' ALA . 27.8 m -68.7 -35.21 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 120.457 -0.497 . . . . 214.56 111.715 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.83 -41.55 95.98 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.002 0.43 . . . . 61.909999999999997 110.003 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.748 HD11 ' HA3' ' A' ' 89' ' ' GLY . 58.1 tp -68.82 -40.42 79.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.691 -0.686 . . . . 321.58999999999997 111.132 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -60.23 -38.01 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.04 -0.527 . . . . 491.97000000000003 111.881 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 69.0 t -63.04 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.622 0.249 . . . . 179.68000000000001 110.944 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.29 -41.52 89.68 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.644 0.259 . . . . 483.12 111.261 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.6 mt -70.09 -44.13 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.177 -0.465 . . . . 120.91 111.789 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.445 ' O ' ' HB2' ' A' ' 28' ' ' ASP . 6.3 tp -63.42 -33.9 64.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 CA-C-N 116.289 -0.414 . . . . 324.41000000000003 111.85 -178.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.57 -45.98 91.81 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.016 0.376 . . . . 76.379999999999995 112.016 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.28 -44.83 84.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.572 -0.823 . . . . 59.560000000000002 113.147 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -72.65 -18.66 61.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.194 0.442 . . . . 169.43000000000001 112.194 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 34.2 t70 -74.8 -39.48 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.1 -0.24 . . . . 145.09 111.561 -178.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -63.84 -41.34 97.84 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.616 -0.434 . . . . 779.76999999999998 110.174 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -41.02 99.84 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.831 -0.622 . . . . 72.329999999999998 112.078 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.7 tp -63.53 -44.42 94.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.682 0.277 . . . . 213.66999999999999 110.367 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.5 t -61.61 -44.6 98.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-N 116.11 -0.496 . . . . 275.81999999999999 110.813 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -62.24 -40.29 95.65 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.51 -0.314 . . . . 545.0 110.977 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.618 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 52.1 t90 -65.33 -42.01 93.38 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.398 -0.593 . . . . 999.99000000000001 109.398 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 86.6 mt -62.69 -35.49 79.88 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.271 -0.877 . . . . 205.93000000000001 111.296 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.94 -36.08 80.34 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.754 0.279 . . . . 557.46000000000004 111.754 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -86.31 -51.03 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 113.684 0.994 . . . . 284.56999999999999 113.684 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.619 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.2 m-70 -101.18 0.97 38.57 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.666 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -60.88 -36.48 92.11 Favored Glycine 0 N--CA 1.461 0.327 0 N-CA-C 114.095 0.398 . . . . 199.69999999999999 114.095 -179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -58.94 -39.42 81.57 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.818 0.303 . . . . 999.99000000000001 111.818 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -89.76 -10.19 46.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.861 0.689 . . . . 302.80000000000001 112.861 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.666 HD12 ' HA2' ' A' ' 39' ' ' GLY . 88.1 mt -73.0 138.38 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.89 0.376 . . . . 581.97000000000003 111.79 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.6 p -78.16 169.11 18.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 239.06999999999999 110.011 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.98 -42.27 98.05 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.751 0.31 . . . . 192.00999999999999 110.972 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.562 HG13 ' HB2' ' A' ' 114' ' ' TYR . 75.1 t -66.69 -43.26 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 116.232 -0.44 . . . . 278.44999999999999 111.145 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -63.19 -40.29 97.07 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.104 0.409 . . . . 316.42000000000002 112.104 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -61.09 -46.15 91.8 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.68 0.276 . . . . 470.35000000000002 111.061 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -70.67 -37.66 73.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.352 -0.385 . . . . 369.77999999999997 111.101 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.9 -36.77 80.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 66.790000000000006 111.888 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.55 -37.08 80.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.056 0.391 . . . . 238.30000000000001 112.056 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -61.56 -38.96 89.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.62 -0.511 . . . . 526.92999999999995 109.62 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -66.99 -39.32 87.13 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.742 -0.663 . . . . 162.88 109.481 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.16 -39.6 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.544 -0.753 . . . . 139.00999999999999 111.062 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -58.31 -42.33 86.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.436 -0.347 . . . . 198.61000000000001 110.731 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 94.9 mtm-85 -66.35 -39.35 89.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.152 -0.219 . . . . 999.99000000000001 110.46 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -63.51 -38.67 92.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.227 0.537 . . . . 799.64999999999998 109.751 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.72 -46.4 89.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.06 -0.973 . . . . 151.58000000000001 109.555 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 87.1 mtp -61.49 -42.99 99.63 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.768 -0.651 . . . . 168.43000000000001 110.865 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -62.72 -40.01 95.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.663 -0.699 . . . . 530.55999999999995 112.301 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -61.22 -49.32 77.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.734 0.302 . . . . 293.49000000000001 111.619 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -72.66 -39.31 67.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 383.72000000000003 111.92 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -64.58 -43.87 92.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 497.0 112.265 -178.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.64 -39.8 81.56 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.869 0.692 . . . . 177.0 112.869 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -60.8 -47.58 85.67 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.738 -0.21 . . . . 478.75999999999999 111.546 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.604 ' HB3' HD22 ' A' ' 88' ' ' LEU . 82.7 m-85 -71.28 -42.44 68.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.703 0.287 . . . . 727.09000000000003 111.77 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 96.9 mmm -56.39 -41.82 76.91 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 113.494 0.924 . . . . 664.46000000000004 113.494 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.2 tp -58.99 -46.62 87.69 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.189 0.44 . . . . 447.74000000000001 112.189 -177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -65.63 -42.45 91.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.863 0.363 . . . . 999.99000000000001 111.267 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.532 HG13 HD11 ' A' ' 88' ' ' LEU . 49.2 mm -72.0 -43.77 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 116.016 -0.538 . . . . 398.94999999999999 112.098 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.35 -38.77 88.18 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.942 0.349 . . . . 366.97000000000003 111.942 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -59.96 -45.94 91.01 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.697 -0.483 . . . . 709.00999999999999 109.697 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.89 -40.97 92.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.894 -0.594 . . . . 931.13999999999999 110.972 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 92.5 mt -62.26 -48.09 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.34 -0.391 . . . . 175.25999999999999 111.2 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.467 ' OD2' ' HA ' ' A' ' 8' ' ' PRO . 95.5 m-20 -63.39 -42.63 98.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 443.19 111.712 -179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.06 89.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 366.44 112.016 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -40.15 61.56 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.851 0.357 . . . . 386.93000000000001 111.55 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.28 -9.95 73.94 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.152 -0.547 . . . . 244.66999999999999 112.827 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -75.31 133.94 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.381 -0.229 . . . . 999.99000000000001 110.381 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.8 p -73.93 139.38 76.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.785 -0.189 . . . . 263.29000000000002 111.12 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.58 145.05 32.7 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.505 2.136 . . . . 173.88999999999999 113.203 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.7 m -102.68 170.23 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.936 -0.575 . . . . 201.66 110.854 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.92 -40.08 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.758 0.313 . . . . 81.090000000000003 110.461 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.1 -38.86 93.64 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.071 -0.513 . . . . 106.63 112.444 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.444 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.8 t70 -61.66 -42.71 99.28 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.96 -0.385 . . . . 397.23000000000002 109.96 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.512 ' HB3' HD22 ' A' ' 19' ' ' LEU . 56.9 m-85 -66.3 -40.45 89.99 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.755 -0.657 . . . . 176.41 111.27 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.7 p -66.12 -32.98 74.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.595 0.22 . . . . 224.31999999999999 111.595 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -61.73 -46.07 91.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.405 -0.591 . . . . 999.99000000000001 109.405 178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 65' ' ' TYR . 92.9 mt -66.75 -40.74 88.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.465 -0.789 . . . . 158.16999999999999 110.347 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.748 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.61 -39.57 98.05 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.439 -0.8 . . . . 65.709999999999994 113.685 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -60.54 -40.48 91.7 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.695 0.283 . . . . 95.379999999999995 110.988 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.61 -40.5 95.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.981 -0.554 . . . . 381.13999999999999 110.241 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.73 -43.43 96.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.56 -0.746 . . . . 182.12 111.146 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.24 -13.92 63.18 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-N 115.824 -0.625 . . . . 88.799999999999997 114.001 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -79.38 -15.66 57.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.305 0.552 . . . . 999.99000000000001 111.479 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -108.66 111.81 23.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 999.99000000000001 110.93 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 77.4 mt -124.47 120.35 58.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.809 -0.441 . . . . 308.67000000000002 109.809 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -152.6 55.21 0.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 388.05000000000001 111.2 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.4 mmm -64.48 -38.83 92.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.009 -0.542 . . . . 360.56999999999999 111.704 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.38 89.37 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 184.22999999999999 111.675 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -60.02 -47.52 85.51 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.918 -0.583 . . . . 999.99000000000001 111.637 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -57.75 -45.73 85.49 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.122 0.264 . . . . 374.13 111.062 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.56 -48.13 82.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.569 0.223 . . . . 999.99000000000001 110.546 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.94 -41.69 99.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.417 -0.356 . . . . 558.87 110.98 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.48 94.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.101 -0.5 . . . . 332.85000000000002 111.055 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 110' ' ' MET . 59.6 tp -61.07 -43.79 98.35 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.652 -0.703 . . . . 472.20999999999998 110.587 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -62.96 -39.84 95.87 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.189 -0.46 . . . . 821.44000000000005 110.557 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.38 -40.36 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.741 -0.663 . . . . 746.24000000000001 111.503 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -82.74 -11.52 58.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.324 -0.398 . . . . 999.99000000000001 111.507 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.9 t30 54.89 44.91 27.59 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.527 0.517 . . . . 675.44000000000005 111.576 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . 0.417 ' O ' HD11 ' A' ' 105' ' ' LEU . 66.9 mtt -115.39 83.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 999.99000000000001 110.878 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.8 mm -93.42 116.81 67.02 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.657 0.265 . . . . 390.38 110.642 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.54 150.31 45.56 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.718 2.279 . . . . 243.11000000000001 112.754 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -84.25 142.18 30.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 618.10000000000002 110.225 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.562 ' HB2' HG13 ' A' ' 45' ' ' VAL . 67.3 t80 -68.13 113.77 6.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 999.99000000000001 110.653 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -99.31 148.63 34.92 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.099 -0.5 . . . . 415.25 111.364 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.93 -19.2 58.33 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.841 2.361 . . . . 529.14999999999998 111.873 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -61.53 -35.88 78.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.743 . . . . 516.88 110.855 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 17.8 tpt -58.41 -42.23 86.72 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.081 -0.508 . . . . 914.60000000000002 110.574 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.17 -40.4 93.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.16 -0.473 . . . . 675.30999999999995 110.429 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -63.66 -42.31 98.1 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.115 -0.493 . . . . 900.95000000000005 111.031 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 32.0 mm -61.67 -45.14 99.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 116.433 -0.349 . . . . 300.73000000000002 110.807 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.968 -0.56 . . . . 595.28999999999996 111.524 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -67.6 -33.66 75.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.293 0.479 . . . . 999.99000000000001 112.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -80.3 137.36 36.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 385.68000000000001 112.034 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.481 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.2 mtt-85 -53.5 144.04 34.28 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.627 -0.715 . . . . 999.99000000000001 111.413 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.46 -33.77 68.89 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.116 2.544 . . . . 149.59999999999999 112.86 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -60.75 -35.94 77.66 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.066 -0.515 . . . . 147.02000000000001 111.809 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -91.27 0.97 57.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.41 -0.359 . . . . 360.37 111.944 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 125' ' ' ARG . 57.5 t -96.0 111.15 55.25 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.779 0.323 . . . . 187.93000000000001 110.811 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -77.04 163.05 31.29 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.782 2.321 . . . . 265.38999999999999 112.969 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.4 m -120.9 153.92 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.053 -0.521 . . . . 246.78 109.857 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -116.75 124.06 48.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.041 0.448 . . . . 999.99000000000001 111.352 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -83.2 148.95 27.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 495.41000000000003 109.825 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.032 -0.985 . . . . 761.34000000000003 110.945 -179.503 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.498 HG21 ' HG2' ' A' ' 71' ' ' LYS . 61.4 t . . . . . 0 C--O 1.231 0.095 0 N-CA-C 110.22 -0.289 . . . . 375.51999999999998 110.22 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 96.6 mt-10 -90.72 121.94 67.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.494 -0.321 . . . . 999.99000000000001 110.982 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 48.6 Cg_exo -59.91 146.86 94.79 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.7 2.267 . . . . 436.63 112.06 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -61.64 -40.29 94.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.331 -0.395 . . . . 999.99000000000001 111.777 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -148.81 90.2 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.179 -0.208 . . . . 999.99000000000001 111.084 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 56.9 tp -58.98 122.91 14.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.276 -0.42 . . . . 781.60000000000002 110.381 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -101.43 102.65 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.921 0.391 . . . . 216.75 110.61 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -65.06 -38.51 91.04 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.799 -0.637 . . . . 902.89999999999998 112.052 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.71 84.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.043 0.386 . . . . 121.34999999999999 112.043 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.018 -0.364 . . . . 265.05000000000001 110.018 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -63.89 -40.58 96.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.875 -0.602 . . . . 524.44000000000005 110.456 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -62.18 -47.32 93.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.963 -0.562 . . . . 214.56 111.19 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.94 98.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 61.909999999999997 111.453 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 85' ' ' TYR . 85.3 mt -69.06 -39.01 79.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.273 0.471 . . . . 321.58999999999997 112.273 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.561 ' HE3' HG21 ' A' ' 131' ' ' VAL . 6.3 mttm -57.56 -42.85 83.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.861 1.06 . . . . 491.97000000000003 113.861 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.29 -37.23 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.211 -0.595 . . . . 179.68000000000001 111.232 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -70.89 -39.89 72.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 483.12 110.718 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.419 HG21 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -63.58 -43.64 98.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.672 -0.694 . . . . 120.91 111.177 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -59.64 -42.83 89.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.008 -0.542 . . . . 324.41000000000003 111.409 -178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.51 96.7 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.042 -0.263 . . . . 76.379999999999995 111.385 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.26 -42.87 93.92 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 120.898 -0.668 . . . . 59.560000000000002 112.938 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -73.37 -20.15 60.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.959 0.355 . . . . 169.43000000000001 111.959 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -77.17 -33.89 56.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.662 -0.245 . . . . 145.09 110.732 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -61.55 -42.71 99.23 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 109.807 -0.442 . . . . 779.76999999999998 109.807 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.19 -38.67 82.82 Favored Glycine 0 CA--C 1.519 0.293 0 CA-C-N 115.846 -0.615 . . . . 72.329999999999998 112.141 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.9 tp -62.87 -44.64 95.58 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.238 0.458 . . . . 213.66999999999999 112.238 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.62 -31.79 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 120.799 -0.36 . . . . 275.81999999999999 111.588 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -40.79 97.31 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.918 0.39 . . . . 545.0 109.964 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -64.03 -43.85 94.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.599 -0.728 . . . . 999.99000000000001 109.904 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.76 -37.58 84.81 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.176 -0.92 . . . . 205.93000000000001 111.575 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -68.31 -20.28 64.74 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.983 0.364 . . . . 557.46000000000004 111.983 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.1 t -84.09 -41.45 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.914 0.388 . . . . 284.56999999999999 111.136 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -103.92 19.08 20.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.884 0.373 . . . . 350.44 110.895 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.51 -35.88 82.13 Favored Glycine 0 N--CA 1.459 0.228 0 CA-C-N 115.529 -0.76 . . . . 199.69999999999999 114.122 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -59.74 -39.59 85.25 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.936 0.346 . . . . 999.99000000000001 111.936 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.2 p -110.24 12.22 23.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.66 0.615 . . . . 302.80000000000001 112.66 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.474 HD22 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.35 123.69 22.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 581.97000000000003 111.663 -179.328 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.462 ' HB2' ' HB2' ' A' ' 46' ' ' GLN . 70.7 m -78.67 154.66 29.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.092 -0.504 . . . . 239.06999999999999 110.491 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -61.1 -46.45 90.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.862 0.319 . . . . 192.00999999999999 111.862 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.5 t -73.01 -30.23 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 121.114 0.483 . . . . 278.44999999999999 110.452 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.462 ' HB2' ' HB2' ' A' ' 43' ' ' SER . 64.6 tt0 -60.62 -38.98 86.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.462 -0.79 . . . . 316.42000000000002 111.27 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -59.29 -46.32 88.87 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 110.342 -0.244 . . . . 470.35000000000002 110.342 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.43 -39.4 92.06 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.987 0.422 . . . . 369.77999999999997 110.595 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.4 87.82 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.741 -0.663 . . . . 66.790000000000006 111.818 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.42 -37.01 72.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.269 -0.423 . . . . 238.30000000000001 111.975 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -63.75 -40.75 97.46 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.736 0.303 . . . . 526.92999999999995 110.217 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.96 -43.55 92.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.968 -0.56 . . . . 162.88 109.94 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 68.6 t -61.19 -41.03 87.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.487 -0.779 . . . . 139.00999999999999 110.077 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -59.7 -42.72 93.64 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.91 -0.586 . . . . 198.61000000000001 110.272 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.404 ' NH1' ' HA ' ' A' ' 122' ' ' ASN . 99.2 mtt180 -63.71 -41.61 98.06 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.702 -0.227 . . . . 999.99000000000001 110.91 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -62.13 -45.54 93.02 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.024 0.44 . . . . 799.64999999999998 110.064 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -60.4 -45.92 91.83 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.602 -0.726 . . . . 151.58000000000001 110.156 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.419 ' SD ' HG21 ' A' ' 23' ' ' ILE . 30.3 ttp -58.81 -42.92 90.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.304 -0.862 . . . . 168.43000000000001 110.821 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.33 -42.35 98.97 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.276 -0.42 . . . . 530.55999999999995 111.832 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.3 p -71.55 -39.09 70.89 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 111.69 0.255 . . . . 293.49000000000001 111.69 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -64.25 -45.83 86.42 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.139 0.495 . . . . 383.72000000000003 110.406 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.78 -39.65 91.2 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.691 -0.686 . . . . 497.0 112.538 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -43.19 89.64 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.084 0.402 . . . . 177.0 112.084 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.03 -47.41 83.18 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.858 0.361 . . . . 478.75999999999999 111.108 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.428 ' HE2' HD23 ' A' ' 88' ' ' LEU . 62.1 t80 -68.38 -44.34 75.38 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.053 -0.521 . . . . 727.09000000000003 111.326 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.2 ttp -53.56 -46.03 70.09 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.752 -0.658 . . . . 664.46000000000004 112.195 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.9 mt -61.54 -39.88 92.65 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.716 0.265 . . . . 447.74000000000001 111.716 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -62.07 -47.79 83.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.448 -0.342 . . . . 999.99000000000001 111.656 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 pt -80.42 -28.09 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.671 0.619 . . . . 398.94999999999999 112.671 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -61.45 -40.2 93.65 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.526 0.203 . . . . 366.97000000000003 111.433 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.498 ' HG2' HG21 ' A' ' 6' ' ' VAL . 98.2 mttt -61.76 -42.18 98.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.488 -0.324 . . . . 709.00999999999999 110.592 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -67.96 -42.14 81.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 931.13999999999999 111.044 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.86 -46.91 92.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.291 -0.413 . . . . 175.25999999999999 111.063 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -63.37 -43.86 96.45 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.211 -0.449 . . . . 443.19 111.471 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.98 95.93 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.214 -0.448 . . . . 366.44 111.823 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.35 -40.68 67.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.473 -0.33 . . . . 386.93000000000001 111.173 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -8.17 79.55 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.89 -0.672 . . . . 244.66999999999999 112.706 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.0 mtp180 -74.23 142.83 45.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.787 0.327 . . . . 999.99000000000001 110.864 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.2 p -103.21 113.07 66.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.487 -0.324 . . . . 263.29000000000002 111.146 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.61 151.64 58.62 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.596 2.197 . . . . 173.88999999999999 112.829 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -100.68 178.52 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.938 -0.574 . . . . 201.66 111.512 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 86' ' ' THR . 68.5 t -59.71 -43.41 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.868 -0.606 . . . . 81.090000000000003 110.937 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.27 -40.84 97.93 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.789 -0.72 . . . . 106.63 112.463 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.001 0.429 . . . . 397.23000000000002 110.154 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.555 ' HB3' HD21 ' A' ' 19' ' ' LEU . 22.5 m-85 -64.75 -39.08 93.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.618 -0.719 . . . . 176.41 112.044 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 82' ' ' VAL . 75.9 p -65.87 -33.13 75.12 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.829 0.307 . . . . 224.31999999999999 111.829 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -61.94 -47.09 86.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.089 0.471 . . . . 999.99000000000001 109.969 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.428 HD23 ' HE2' ' A' ' 65' ' ' TYR . 10.9 mp -70.12 -40.25 74.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.728 -0.669 . . . . 158.16999999999999 110.575 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.68 -39.75 97.84 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.74 -0.664 . . . . 65.709999999999994 112.81 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.14 93.13 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.738 0.304 . . . . 95.379999999999995 110.887 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.23 -40.84 94.59 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.129 -0.487 . . . . 381.13999999999999 110.173 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.96 -43.11 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.818 . . . . 182.12 111.183 179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.59 -24.88 66.57 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 116.156 -0.475 . . . . 88.799999999999997 113.578 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -81.18 -12.67 59.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 0.329 . . . . 999.99000000000001 111.804 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.4 mmt180 -108.38 112.43 24.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.97 0.414 . . . . 999.99000000000001 111.366 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 pt -134.32 153.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 308.67000000000002 110.623 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -152.93 43.23 0.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.048 0.452 . . . . 388.05000000000001 110.664 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.7 mtp -65.23 -36.55 84.51 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.811 -0.631 . . . . 360.56999999999999 111.737 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.13 84.14 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.061 -0.518 . . . . 184.22999999999999 111.609 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -60.04 -48.41 81.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.551 -0.295 . . . . 999.99000000000001 110.694 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -43.53 98.55 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.274 -0.421 . . . . 374.13 110.338 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -47.83 84.25 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.985 -0.552 . . . . 999.99000000000001 110.807 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.36 -40.31 93.83 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.252 -0.431 . . . . 558.87 110.899 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.03 99.85 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.409 -0.359 . . . . 332.85000000000002 110.924 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.34 -40.81 94.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.048 -0.524 . . . . 472.20999999999998 110.663 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.97 -42.6 99.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.816 -0.629 . . . . 821.44000000000005 111.13 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.66 -42.39 83.44 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.97 -0.559 . . . . 746.24000000000001 111.744 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.0 1.77 56.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.524 -0.307 . . . . 999.99000000000001 111.352 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 57.96 41.65 24.1 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.237 0.615 . . . . 675.44000000000005 111.925 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.95 81.63 2.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.935 0.397 . . . . 999.99000000000001 110.513 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.2 mt -93.84 118.61 67.36 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.503 . . . . 390.38 110.401 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.82 149.11 53.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.598 2.199 . . . . 243.11000000000001 112.717 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.71 135.92 33.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.242 -0.436 . . . . 618.10000000000002 110.436 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.73 109.36 3.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.357 . . . . 999.99000000000001 111.014 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 89.0 mt -97.23 125.08 46.98 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 415.25 111.237 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 77.2 Cg_exo -55.47 -31.96 80.33 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.277 2.651 . . . . 529.14999999999998 113.051 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -62.12 -36.52 81.99 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.371 -0.377 . . . . 516.88 111.091 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 61.1 mtt -60.31 -38.73 84.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.449 -0.341 . . . . 914.60000000000002 110.319 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.11 -39.44 89.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.932 -0.576 . . . . 675.30999999999995 110.291 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 124' ' ' MET . 97.9 mt-10 -64.03 -40.15 95.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.999 -0.546 . . . . 900.95000000000005 110.909 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.6 mt -61.42 -41.79 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.022 0.439 . . . . 300.73000000000002 110.45 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . 0.404 ' HA ' ' NH1' ' A' ' 55' ' ' ARG . 99.4 m-20 -60.33 -37.34 80.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 595.28999999999996 110.89 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -74.74 -10.85 59.91 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.077 -0.511 . . . . 999.99000000000001 112.335 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 65.4 mtt -77.38 119.91 21.66 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.982 -0.287 . . . . 385.68000000000001 110.786 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -52.98 120.72 20.34 Favored Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 116.015 -0.538 . . . . 999.99000000000001 112.012 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -58.92 -35.83 97.93 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.884 2.39 . . . . 149.59999999999999 112.827 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.32 -37.07 85.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.695 0.628 . . . . 147.02000000000001 112.695 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -90.84 -22.07 21.16 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.432 0.53 . . . . 360.37 112.432 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 124' ' ' MET . 62.0 t -105.34 109.02 62.73 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 121.028 -0.269 . . . . 187.93000000000001 110.774 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.85 138.98 85.99 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.476 2.117 . . . . 265.38999999999999 112.463 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.561 HG21 ' HE3' ' A' ' 20' ' ' LYS . 96.6 t -128.54 137.7 56.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.127 -0.488 . . . . 246.78 111.31 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -122.9 147.72 46.27 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.218 -0.66 . . . . 999.99000000000001 109.218 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -83.52 125.72 32.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.727 0.298 . . . . 495.41000000000003 110.99 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.4 mtm . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.4 -0.81 . . . . 761.34000000000003 111.311 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.233 0.221 0 N-CA-C 109.913 -0.403 . . . . 375.51999999999998 109.913 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -80.94 119.31 75.68 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.281 -0.418 . . . . 999.99000000000001 111.046 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -59.69 144.9 99.34 Favored 'Trans proline' 0 C--N 1.35 0.605 0 C-N-CA 122.973 2.449 . . . . 436.63 111.854 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -120.35 151.42 39.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.822 0.344 . . . . 999.99000000000001 111.733 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 63.36 29.17 15.7 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.291 -0.868 . . . . 999.99000000000001 112.605 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -57.99 128.22 36.02 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.641 0.258 . . . . 781.60000000000002 111.078 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -114.07 114.74 26.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.594 -0.276 . . . . 216.75 110.414 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.76 -39.39 94.0 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.252 -0.431 . . . . 902.89999999999998 111.635 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.91 87.6 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.409 -0.359 . . . . 121.34999999999999 111.642 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -68.37 -31.37 70.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 265.05000000000001 110.398 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.76 -39.91 95.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.909 -0.587 . . . . 524.44000000000005 110.679 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.8 t -62.13 -46.81 95.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.013 0.435 . . . . 214.56 110.86 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.57 93.99 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.626 -0.715 . . . . 61.909999999999997 110.596 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 85' ' ' TYR . 65.1 tp -64.27 -45.28 88.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.602 -0.726 . . . . 321.58999999999997 111.883 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -61.77 -40.75 96.27 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.259 0.837 . . . . 491.97000000000003 113.259 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.65 -33.76 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.221 -0.591 . . . . 179.68000000000001 111.485 -179.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.05 -40.67 78.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.047 0.451 . . . . 483.12 109.898 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.15 -43.29 95.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 115.442 -0.799 . . . . 120.91 110.64 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -60.88 -43.27 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.839 -0.619 . . . . 324.41000000000003 111.276 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -43.32 98.49 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.618 0.229 . . . . 76.379999999999995 111.618 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.24 -42.28 97.95 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.881 -0.676 . . . . 59.560000000000002 112.733 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -74.7 -18.29 60.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.8 0.333 . . . . 169.43000000000001 111.505 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -75.73 -31.79 59.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.344 -0.389 . . . . 145.09 110.912 -178.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -60.76 -46.08 91.83 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.465 -0.569 . . . . 779.76999999999998 109.465 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.98 93.56 Favored Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.605 -0.725 . . . . 72.329999999999998 111.751 178.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.87 -48.27 82.59 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.428 -0.386 . . . . 213.66999999999999 111.655 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.89 -29.45 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 C-N-CA 120.929 -0.308 . . . . 275.81999999999999 111.214 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.528 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 64.2 tttm -62.41 -43.78 98.0 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.967 0.413 . . . . 545.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.792 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 27.5 t90 -70.22 -39.51 75.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.16 -0.473 . . . . 999.99000000000001 110.18 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.29 -38.42 91.09 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.619 0.6 . . . . 205.93000000000001 112.619 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -66.32 -19.17 65.74 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.885 -0.509 . . . . 557.46000000000004 111.431 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.11 -52.56 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 112.551 0.575 . . . . 284.56999999999999 112.551 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -111.6 -8.08 14.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.951 0.723 . . . . 350.44 112.951 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.64 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -67.82 -17.82 69.76 Favored Glycine 0 N--CA 1.46 0.241 0 C-N-CA 121.252 -0.499 . . . . 199.69999999999999 113.567 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -61.18 -39.37 89.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.752 0.31 . . . . 999.99000000000001 111.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -91.6 -8.22 47.92 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.688 0.625 . . . . 302.80000000000001 112.688 -179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.792 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 96.1 mt -72.8 141.86 48.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.884 0.373 . . . . 581.97000000000003 111.509 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.9 p -77.59 168.44 19.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.068 -0.514 . . . . 239.06999999999999 110.375 178.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 87.0 m -60.9 -40.44 93.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.881 0.372 . . . . 192.00999999999999 110.713 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.679 HG13 ' HB2' ' A' ' 114' ' ' TYR . 61.8 t -65.6 -44.28 93.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.004 -0.543 . . . . 278.44999999999999 110.946 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -63.99 -41.57 97.47 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.422 -0.354 . . . . 316.42000000000002 111.232 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -62.89 -46.32 88.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.458 -0.337 . . . . 470.35000000000002 110.825 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -65.09 -40.72 94.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.118 -0.492 . . . . 369.77999999999997 110.909 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.19 78.95 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.859 -0.61 . . . . 66.790000000000006 111.499 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.01 -39.18 81.09 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.043 -0.526 . . . . 238.30000000000001 111.327 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -60.77 -40.17 91.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.701 0.286 . . . . 526.92999999999995 110.527 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.506 ' HB2' ' SD ' ' A' ' 118' ' ' MET . 61.4 t80 -66.39 -39.75 89.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.219 -0.446 . . . . 162.88 109.887 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.7 t -60.99 -43.86 96.95 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.712 -0.676 . . . . 139.00999999999999 110.025 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.68 -40.4 91.99 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.903 -0.59 . . . . 198.61000000000001 109.98 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' MET . 77.4 ttt-85 -60.35 -47.91 84.01 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.808 -0.633 . . . . 999.99000000000001 110.757 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.4 mmm-85 -64.59 -40.77 96.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.098 0.475 . . . . 799.64999999999998 110.793 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -62.51 -48.16 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.663 -0.698 . . . . 151.58000000000001 112.48 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.499 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 4.9 ppp? -64.36 -38.37 90.79 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.172 0.804 . . . . 168.43000000000001 113.172 -178.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.41 -39.14 71.3 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.482 -0.487 . . . . 530.55999999999995 111.78 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.6 p -73.82 -41.33 62.47 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 111.72 0.267 . . . . 293.49000000000001 111.72 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -63.76 -45.87 87.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.834 0.35 . . . . 383.72000000000003 110.427 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.456 ' CZ2' HD21 ' A' ' 19' ' ' LEU . 74.9 t-105 -62.38 -47.56 83.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.896 -0.593 . . . . 497.0 111.729 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.73 88.33 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.502 -0.317 . . . . 177.0 111.709 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -61.41 -46.87 88.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.838 0.351 . . . . 478.75999999999999 110.709 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.51 -46.7 84.85 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 727.09000000000003 110.865 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.5 mmm -52.04 -19.66 2.0 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.183 1.179 . . . . 664.46000000000004 114.183 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.0 mt -59.77 -43.59 94.27 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 118.257 0.481 . . . . 447.74000000000001 110.587 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -68.43 -45.54 72.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.03 -0.532 . . . . 999.99000000000001 111.271 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.0 mm -67.95 -41.11 84.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 115.465 -0.789 . . . . 398.94999999999999 112.787 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -59.2 -39.15 81.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.052 0.39 . . . . 366.97000000000003 112.052 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.83 -42.28 97.42 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 121.042 -0.263 . . . . 709.00999999999999 110.955 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.29 -42.06 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.528 -0.306 . . . . 931.13999999999999 111.64 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.67 -47.99 88.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.53 -0.305 . . . . 175.25999999999999 111.291 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.31 -40.32 97.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.219 -0.446 . . . . 443.19 111.504 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.31 -40.74 96.54 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.495 -0.32 . . . . 366.44 111.51 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.26 -40.28 77.92 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.817 0.341 . . . . 386.93000000000001 111.279 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.05 -8.48 79.75 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.978 -0.63 . . . . 244.66999999999999 112.776 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.6 mmt180 -74.57 145.63 43.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.61 0.243 . . . . 999.99000000000001 111.063 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 79.8 p -72.14 138.12 81.77 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.436 -0.347 . . . . 263.29000000000002 110.845 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 36.1 Cg_exo -61.51 135.36 56.62 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.537 2.158 . . . . 173.88999999999999 112.842 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.632 HG13 ' H ' ' A' ' 84' ' ' ASP . 12.2 p -104.07 150.58 7.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.467 -0.333 . . . . 201.66 110.235 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.93 -42.07 95.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 111.974 0.361 . . . . 81.090000000000003 111.974 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.23 -43.13 97.42 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 120.906 -0.664 . . . . 106.63 113.546 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.632 ' H ' HG13 ' A' ' 81' ' ' VAL . 36.9 t70 -63.89 -43.02 97.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.03 0.443 . . . . 397.23000000000002 110.435 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD13 ' A' ' 19' ' ' LEU . 3.9 m-30 -64.42 -41.12 96.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.545 -0.752 . . . . 176.41 111.774 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.5 p -67.91 -36.19 79.76 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 121.011 -0.276 . . . . 224.31999999999999 111.306 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -62.61 -45.99 90.34 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.223 0.535 . . . . 999.99000000000001 109.639 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.72 -39.8 91.54 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.42 -0.809 . . . . 158.16999999999999 110.53 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.67 -39.71 97.78 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.633 -0.712 . . . . 65.709999999999994 112.771 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.71 94.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.651 0.262 . . . . 95.379999999999995 110.971 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -65.54 -40.65 93.12 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.144 0.497 . . . . 381.13999999999999 110.522 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.2 mm -65.52 -41.79 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.461 -0.791 . . . . 182.12 111.21 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.41 -16.96 61.32 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.899 -0.592 . . . . 88.799999999999997 113.707 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -79.78 -13.92 59.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 117.034 0.417 . . . . 999.99000000000001 111.362 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -108.58 119.81 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.772 0.32 . . . . 999.99000000000001 110.433 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.2 pt -129.82 156.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 308.67000000000002 111.483 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -136.21 21.62 3.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.344 0.592 . . . . 388.05000000000001 109.974 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.5 mtp -64.54 -39.48 93.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.324 -0.853 . . . . 360.56999999999999 112.23 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.98 -40.88 97.11 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.246 0.461 . . . . 184.22999999999999 112.246 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -78.5 -21.6 48.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.594 -0.275 . . . . 999.99000000000001 111.687 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.481 ' CE2' HD11 ' A' ' 105' ' ' LEU . 88.3 t80 -59.46 -46.76 87.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.474 -0.33 . . . . 374.13 111.013 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -62.0 -39.44 92.24 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.697 0.284 . . . . 999.99000000000001 110.902 179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -62.59 -42.72 99.73 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.112 -0.495 . . . . 558.87 110.23 179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.23 -40.24 95.47 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.802 -0.635 . . . . 332.85000000000002 111.092 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.55 -42.12 99.34 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.355 -0.384 . . . . 472.20999999999998 110.835 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.66 -44.0 97.37 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.279 -0.419 . . . . 821.44000000000005 110.976 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.89 -39.92 82.85 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.032 -0.531 . . . . 746.24000000000001 111.935 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.17 -2.23 56.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.45 -0.341 . . . . 999.99000000000001 111.527 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.2 t30 56.66 43.71 24.99 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 123.64 0.588 . . . . 675.44000000000005 111.299 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 78.9 mtm -103.85 111.16 23.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.368 . . . . 999.99000000000001 111.371 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 72.3 mt -94.67 118.92 66.79 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 390.38 109.996 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.83 118.88 5.77 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.159 1.906 . . . . 243.11000000000001 112.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.75 142.88 28.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 618.10000000000002 110.623 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.679 ' HB2' HG13 ' A' ' 45' ' ' VAL . 86.9 t80 -67.36 125.78 27.18 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.721 0.296 . . . . 999.99000000000001 110.906 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.2 mt -99.53 144.7 28.78 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.269 -0.423 . . . . 415.25 110.87 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.25 -18.89 50.72 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.667 2.245 . . . . 529.14999999999998 112.056 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -62.61 -26.67 68.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.475 -0.784 . . . . 516.88 111.358 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 52' ' ' PHE . 93.9 mmm -59.88 -38.92 83.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.256 -0.429 . . . . 914.60000000000002 111.529 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.88 -40.87 94.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.573 -0.285 . . . . 675.30999999999995 110.73 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -65.35 -40.98 94.3 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.429 -0.35 . . . . 900.95000000000005 111.181 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 28.6 mm -61.91 -45.02 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.384 -0.371 . . . . 300.73000000000002 111.08 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.12 -39.69 95.43 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.024 0.379 . . . . 595.28999999999996 112.024 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -70.19 -33.18 71.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.973 0.731 . . . . 999.99000000000001 112.973 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.7 mtm -88.06 132.93 34.1 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.535 0.569 . . . . 385.68000000000001 112.535 -178.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.9 mmt180 -53.77 145.54 30.68 Favored Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.586 -0.734 . . . . 999.99000000000001 110.874 178.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.61 -30.06 90.97 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.671 2.247 . . . . 149.59999999999999 112.884 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.73 -36.03 81.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.233 -0.439 . . . . 147.02000000000001 111.234 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -91.98 0.48 57.47 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.552 0.575 . . . . 360.37 112.552 -178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 66.3 t -83.13 116.6 65.15 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 187.93000000000001 110.964 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.56 156.34 49.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.821 2.348 . . . . 265.38999999999999 112.696 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 m -129.61 159.93 41.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.13 -0.486 . . . . 246.78 110.564 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -118.12 136.04 53.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.976 0.417 . . . . 999.99000000000001 111.521 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.3 165.64 18.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 495.41000000000003 110.349 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 3.4 mtt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.158 -0.925 . . . . 761.34000000000003 111.082 -179.285 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.0 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.815 0.341 . . . . 375.51999999999998 110.809 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -90.2 120.39 69.17 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 999.99000000000001 110.341 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.28 147.73 53.85 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.661 2.241 . . . . 436.63 112.906 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -157.16 -25.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.047 -0.524 . . . . 999.99000000000001 111.579 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -87.19 -12.63 46.3 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.288 0.477 . . . . 999.99000000000001 112.288 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.63 139.25 54.09 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.099 0.476 . . . . 781.60000000000002 112.036 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -100.52 123.57 44.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.771 -0.65 . . . . 216.75 110.008 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.45 -38.82 88.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.466 . . . . 902.89999999999998 111.282 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.77 86.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.404 -0.362 . . . . 121.34999999999999 111.562 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -68.51 -32.7 72.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 265.05000000000001 110.061 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -64.47 -38.62 91.65 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.8 -0.637 . . . . 524.44000000000005 110.018 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.71 -45.12 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 115.663 -0.699 . . . . 214.56 110.724 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.11 94.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 61.909999999999997 110.68 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.564 HD21 ' HB3' ' A' ' 85' ' ' TYR . 84.8 mt -65.81 -38.59 89.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.899 -0.591 . . . . 321.58999999999997 111.566 178.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -60.61 -38.19 83.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.207 -0.452 . . . . 491.97000000000003 111.695 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.95 -43.6 99.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 179.68000000000001 110.43 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.76 -41.48 97.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.208 -0.451 . . . . 483.12 110.767 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.41 -43.54 97.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.876 -0.602 . . . . 120.91 110.88 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.32 -40.81 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.726 -0.67 . . . . 324.41000000000003 111.64 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.85 -43.32 94.69 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.631 0.234 . . . . 76.379999999999995 111.631 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.41 -42.62 97.56 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.677 -0.773 . . . . 59.560000000000002 112.537 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -72.41 -19.91 61.52 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 111.97 0.359 . . . . 169.43000000000001 111.97 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -31.96 58.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.612 -0.267 . . . . 145.09 111.263 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 41.0 mmt180 -61.57 -42.48 98.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.894 0.378 . . . . 779.76999999999998 110.176 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.17 70.18 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.992 -0.549 . . . . 72.329999999999998 112.195 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -60.71 -46.27 91.03 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.341 0.497 . . . . 213.66999999999999 112.341 -178.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.1 m -68.72 -26.68 33.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 112.37 0.507 . . . . 275.81999999999999 112.37 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 48.5 mmtm -63.6 -43.12 97.84 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.711 0.291 . . . . 545.0 111.072 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.453 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 86.2 m95 -81.14 -28.06 35.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.732 0.301 . . . . 999.99000000000001 111.128 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.84 -43.87 97.7 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.851 -0.613 . . . . 205.93000000000001 111.537 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -70.89 -20.87 62.46 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.822 0.304 . . . . 557.46000000000004 111.822 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.8 t -87.59 -49.75 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.498 0.555 . . . . 284.56999999999999 112.498 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.47 8.75 41.93 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.449 0.537 . . . . 350.44 112.449 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.86 -38.9 96.08 Favored Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.333 -0.461 . . . . 199.69999999999999 113.719 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.7 ptm180 -64.43 -23.65 67.36 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.493 0.553 . . . . 999.99000000000001 112.493 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.529 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.5 p -112.36 1.99 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.085 0.402 . . . . 302.80000000000001 112.085 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.0 tp -72.52 124.4 25.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.348 . . . . 581.97000000000003 111.21 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.6 m -77.93 156.36 30.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 239.06999999999999 110.858 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.4 m -61.08 -42.84 99.24 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.376 -0.375 . . . . 192.00999999999999 111.013 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.592 HG13 ' HB2' ' A' ' 114' ' ' TYR . 66.7 t -66.09 -42.07 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 116.166 -0.47 . . . . 278.44999999999999 110.597 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -62.98 -40.52 97.98 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.066 -0.516 . . . . 316.42000000000002 111.222 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.76 -47.71 85.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.43 -0.35 . . . . 470.35000000000002 110.995 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.24 -40.8 90.48 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.879 0.371 . . . . 369.77999999999997 110.953 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.63 93.91 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.796 -0.638 . . . . 66.790000000000006 111.881 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.3 -39.54 83.34 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.225 -0.443 . . . . 238.30000000000001 112.12 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -62.75 -43.4 98.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.884 -0.326 . . . . 526.92999999999995 110.232 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.62 -48.23 80.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.956 -0.565 . . . . 162.88 110.526 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.417 HG11 ' CZ ' ' A' ' 101' ' ' PHE . 69.2 t -61.76 -42.19 93.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-N 115.52 -0.764 . . . . 139.00999999999999 111.408 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -58.89 -45.77 89.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.688 -0.233 . . . . 198.61000000000001 111.456 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 89.0 mtm180 -65.1 -42.13 94.33 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.943 -0.303 . . . . 999.99000000000001 111.211 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.97 -40.94 95.75 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.214 0.531 . . . . 799.64999999999998 110.57 178.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -61.21 -46.3 91.02 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.295 -0.866 . . . . 151.58000000000001 110.415 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 42.3 ttp -60.43 -40.07 89.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.617 -0.719 . . . . 168.43000000000001 110.998 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 76.6 mt-30 -61.99 -39.79 93.44 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 112.584 0.587 . . . . 530.55999999999995 112.584 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 74.1 p -65.51 -41.74 92.84 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.681 -0.408 . . . . 293.49000000000001 111.584 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 77.9 m-70 -71.06 -40.14 71.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.859 0.362 . . . . 383.72000000000003 110.775 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' A' ' 66' ' ' MET . 69.3 t-105 -62.12 -46.02 90.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.882 -0.599 . . . . 497.0 110.944 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -39.91 83.56 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.22 -0.445 . . . . 177.0 111.567 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -60.6 -45.4 94.13 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.269 -0.423 . . . . 478.75999999999999 111.005 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 57.1 m-85 -68.45 -39.29 81.52 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.269 -0.423 . . . . 727.09000000000003 111.199 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' TRP . 92.9 mmm -55.24 -41.17 71.76 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.413 0.523 . . . . 664.46000000000004 112.413 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.72 -47.71 84.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.826 0.346 . . . . 447.74000000000001 110.473 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.2 t90 -64.96 -45.94 83.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.071 -0.513 . . . . 999.99000000000001 110.828 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.6 -46.82 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.734 -0.666 . . . . 398.94999999999999 111.89 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -61.86 -40.97 97.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.831 -0.168 . . . . 366.97000000000003 111.435 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -62.45 -45.88 91.06 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.442 -0.345 . . . . 709.00999999999999 110.657 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -62.11 -46.55 88.53 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.019 -0.537 . . . . 931.13999999999999 111.075 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.93 -44.25 99.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.1 -0.5 . . . . 175.25999999999999 111.118 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -60.43 -44.18 96.05 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.344 -0.389 . . . . 443.19 111.222 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.48 97.17 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.492 -0.322 . . . . 366.44 111.476 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.01 -40.34 75.31 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.364 -0.38 . . . . 386.93000000000001 111.494 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.61 -4.91 85.08 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 116.068 -0.515 . . . . 244.66999999999999 112.351 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -75.6 154.71 36.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 999.99000000000001 111.435 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.7 p -110.44 95.68 23.67 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 263.29000000000002 110.394 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.77 151.89 57.93 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.799 2.333 . . . . 173.88999999999999 113.703 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.6 m -100.79 -176.5 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.605 -0.725 . . . . 201.66 110.863 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.428 ' O ' HG23 ' A' ' 86' ' ' THR . 70.9 t -60.03 -42.24 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.384 -0.371 . . . . 81.090000000000003 111.01 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.05 96.12 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.848 -0.692 . . . . 106.63 112.814 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.52 -41.89 96.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.078 0.466 . . . . 397.23000000000002 110.348 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 19' ' ' LEU . 38.0 m-85 -67.14 -37.56 84.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.611 -0.722 . . . . 176.41 112.032 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 82' ' ' VAL . 70.3 p -64.96 -28.54 69.59 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.376 0.51 . . . . 224.31999999999999 112.376 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.3 ttp-105 -61.85 -46.35 89.81 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.579 -0.526 . . . . 999.99000000000001 109.579 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.83 -40.08 83.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.545 -0.752 . . . . 158.16999999999999 110.393 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.78 98.22 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.605 -0.725 . . . . 65.709999999999994 112.902 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.15 -40.61 94.5 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.543 0.211 . . . . 95.379999999999995 111.097 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.76 -40.23 94.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.271 -0.422 . . . . 381.13999999999999 110.408 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.69 -43.64 98.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.854 -0.612 . . . . 182.12 110.558 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.97 -21.21 65.43 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.884 -0.598 . . . . 88.799999999999997 113.447 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 85.7 mtp180 -80.14 -17.04 53.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.892 0.346 . . . . 999.99000000000001 111.196 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -109.2 112.73 25.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 999.99000000000001 110.725 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.3 pt -130.3 156.22 42.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.877 0.37 . . . . 308.67000000000002 111.079 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -141.01 34.12 1.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.247 0.546 . . . . 388.05000000000001 110.094 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 99.2 mtp -66.77 -34.26 77.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.427 -0.806 . . . . 360.56999999999999 111.578 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . 0.453 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -59.6 -38.32 80.95 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.253 -0.431 . . . . 184.22999999999999 110.941 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.1 -42.0 93.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.636 -0.711 . . . . 999.99000000000001 110.59 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.417 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 85.4 t80 -58.02 -47.33 83.39 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.967 -0.56 . . . . 374.13 111.505 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -60.41 -42.9 96.95 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.625 0.25 . . . . 999.99000000000001 110.939 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.69 -45.47 78.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.292 -0.413 . . . . 558.87 110.956 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.22 -40.18 96.73 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.866 -0.606 . . . . 332.85000000000002 112.088 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.59 -49.4 77.67 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.516 -0.311 . . . . 472.20999999999998 110.705 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -63.7 -39.27 93.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.814 0.34 . . . . 821.44000000000005 111.093 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.96 -39.88 79.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.921 -0.582 . . . . 746.24000000000001 111.817 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -82.55 -11.29 58.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.896 0.332 . . . . 999.99000000000001 111.896 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 53.51 43.03 31.81 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.394 0.434 . . . . 675.44000000000005 111.79 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -118.27 121.61 40.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.746 0.308 . . . . 999.99000000000001 110.52 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.3 mt -94.66 116.42 66.37 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.421 -0.354 . . . . 390.38 110.226 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.56 136.41 71.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.651 2.234 . . . . 243.11000000000001 112.617 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -85.46 134.42 34.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 618.10000000000002 110.579 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.592 ' HB2' HG13 ' A' ' 45' ' ' VAL . 72.8 t80 -68.24 116.99 9.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.795 0.331 . . . . 999.99000000000001 110.551 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.9 mt -99.38 147.67 33.64 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.404 . . . . 415.25 110.772 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.03 -28.61 66.0 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.542 2.161 . . . . 529.14999999999998 112.098 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.23 -37.91 89.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.861 -0.609 . . . . 516.88 110.813 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.0 mtt -59.6 -42.05 91.69 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-N 116.049 -0.523 . . . . 914.60000000000002 110.4 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -61.81 -44.72 96.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.125 -0.489 . . . . 675.30999999999995 110.817 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.63 -45.05 88.49 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.899 -0.592 . . . . 900.95000000000005 112.462 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.421 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 17.8 tt -72.91 -25.18 21.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 120.735 0.302 . . . . 300.73000000000002 111.719 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.13 -37.99 87.24 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.97 0.414 . . . . 595.28999999999996 111.139 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -85.44 -0.7 55.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 999.99000000000001 111.785 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 121' ' ' ILE . 99.0 mtp -90.15 125.66 35.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.606 0.241 . . . . 385.68000000000001 111.291 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.507 ' O ' HG23 ' A' ' 129' ' ' VAL . 99.5 mtt180 -53.19 141.48 40.63 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-N 115.982 -0.554 . . . . 999.99000000000001 111.035 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.56 -36.63 81.2 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.982 2.454 . . . . 149.59999999999999 112.715 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.6 -34.86 76.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.923 -0.58 . . . . 147.02000000000001 111.781 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.85 0.27 57.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.229 0.455 . . . . 360.37 112.229 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.3 t -85.57 117.02 67.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.749 0.309 . . . . 187.93000000000001 110.624 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.35 155.58 55.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.573 2.182 . . . . 265.38999999999999 112.889 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.5 t -113.77 136.86 48.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 246.78 109.843 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -115.49 131.49 56.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.85 0.357 . . . . 999.99000000000001 111.317 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -81.35 152.23 27.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 495.41000000000003 110.565 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.7 mtp . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.22 -0.895 . . . . 761.34000000000003 110.667 -179.699 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.9 t . . . . . 0 C--O 1.233 0.216 0 N-CA-C 109.653 -0.499 . . . . 375.51999999999998 109.653 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 46.3 mp0 -80.21 121.33 81.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 999.99000000000001 110.77 -178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 47.8 Cg_exo -60.23 141.91 97.03 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.002 2.468 . . . . 436.63 112.709 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -74.36 143.94 44.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.511 . . . . 999.99000000000001 110.295 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -91.23 102.91 15.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.936 0.398 . . . . 999.99000000000001 110.718 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.0 mp -57.82 149.66 21.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.638 -0.71 . . . . 781.60000000000002 111.509 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -65.2 145.73 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.877 -0.416 . . . . 216.75 109.877 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.25 -45.14 91.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.615 -0.266 . . . . 902.89999999999998 111.187 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.35 88.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.5 -0.318 . . . . 121.34999999999999 111.615 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -67.89 -35.22 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 265.05000000000001 110.213 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 95.8 mt-10 -65.18 -38.9 91.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.822 -0.626 . . . . 524.44000000000005 110.161 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.1 -45.6 95.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.823 -0.626 . . . . 214.56 111.104 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.12 98.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.898 -0.592 . . . . 61.909999999999997 111.001 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.5 mt -69.05 -38.85 79.35 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.939 -0.573 . . . . 321.58999999999997 111.948 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 62.4 mtpt -60.74 -39.37 88.43 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.39 0.515 . . . . 491.97000000000003 112.39 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.81 -44.66 99.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.709 0.29 . . . . 179.68000000000001 110.841 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.96 -40.29 91.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.415 -0.357 . . . . 483.12 111.335 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.88 -45.05 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 120.918 0.39 . . . . 120.91 110.829 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.96 -42.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 115.886 -0.597 . . . . 324.41000000000003 111.323 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.32 95.72 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 121.115 -0.234 . . . . 76.379999999999995 111.138 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.72 -42.6 95.2 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.81 -0.71 . . . . 59.560000000000002 112.653 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -71.61 -19.61 62.09 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.626 0.37 . . . . 169.43000000000001 111.916 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.39 -29.01 56.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.828 -0.169 . . . . 145.09 110.887 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.59 -40.56 97.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 779.76999999999998 110.56 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.21 -29.53 40.7 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.703 -0.76 . . . . 72.329999999999998 112.492 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.5 -43.13 95.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.927 0.343 . . . . 213.66999999999999 111.927 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.448 ' HA ' HD12 ' A' ' 35' ' ' LEU . 26.8 m -64.72 -26.09 39.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 112.388 0.514 . . . . 275.81999999999999 112.388 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.84 -43.12 99.49 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.551 0.215 . . . . 545.0 110.85 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -72.2 -35.78 69.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.061 0.457 . . . . 999.99000000000001 110.439 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 32' ' ' VAL . 93.0 mt -62.91 -38.43 90.91 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.524 -0.762 . . . . 205.93000000000001 111.555 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -68.88 -24.02 64.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.661 0.245 . . . . 557.46000000000004 111.661 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.6 t -85.75 -46.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 112.233 0.457 . . . . 284.56999999999999 112.233 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -101.29 8.51 42.4 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.421 0.526 . . . . 350.44 112.421 -178.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.48 -26.54 69.72 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 121.483 -0.389 . . . . 199.69999999999999 113.827 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -61.61 -40.2 93.97 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.772 0.286 . . . . 999.99000000000001 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.0 p -112.96 14.18 19.65 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.037 0.384 . . . . 302.80000000000001 112.037 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.4 tp -71.12 123.53 22.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.983 0.42 . . . . 581.97000000000003 111.515 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.4 m -79.59 159.98 26.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.966 -0.561 . . . . 239.06999999999999 110.865 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.7 m -60.92 -44.98 96.44 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.335 -0.393 . . . . 192.00999999999999 111.456 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 45' ' ' VAL . 1.3 m -71.03 -29.44 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 112.256 0.465 . . . . 278.44999999999999 112.256 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.69 -40.08 94.77 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 121.216 -0.194 . . . . 316.42000000000002 110.987 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.475 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.9 tttp -61.38 -46.68 89.19 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.86 0.362 . . . . 470.35000000000002 110.136 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.953 -0.567 . . . . 369.77999999999997 110.649 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.54 90.52 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 115.848 -0.615 . . . . 66.790000000000006 110.755 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.05 -39.12 93.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.084 -0.507 . . . . 238.30000000000001 111.336 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.475 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 43.4 m-85 -63.18 -38.94 93.17 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 109.249 -0.648 . . . . 526.92999999999995 109.249 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -61.09 -47.57 85.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.454 -0.793 . . . . 162.88 109.678 177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.5 t -62.86 -41.94 94.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 115.991 -0.55 . . . . 139.00999999999999 110.288 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -59.43 -43.1 93.14 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.949 -0.569 . . . . 198.61000000000001 111.053 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HG2' HE21 ' A' ' 59' ' ' GLN . 48.2 ttp180 -61.04 -46.97 88.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.824 0.345 . . . . 999.99000000000001 110.508 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -62.74 -44.57 95.86 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.974 -0.557 . . . . 799.64999999999998 110.464 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.22 -48.11 83.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.505 -0.77 . . . . 151.58000000000001 111.232 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 43.9 ttp -60.74 -45.67 93.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.202 -0.453 . . . . 168.43000000000001 111.379 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.411 HE21 ' HG2' ' A' ' 55' ' ' ARG . 75.3 mt-30 -64.82 -41.12 96.02 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.062 -0.255 . . . . 530.55999999999995 111.063 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -63.68 -45.94 87.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.374 -0.375 . . . . 293.49000000000001 110.693 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -62.55 -46.28 89.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.894 -0.594 . . . . 383.72000000000003 110.132 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -61.51 -47.76 84.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.818 -0.628 . . . . 497.0 111.304 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.93 93.57 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.419 0.525 . . . . 177.0 112.419 -179.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -43.38 96.79 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.187 -0.301 . . . . 478.75999999999999 110.187 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -65.44 -44.26 87.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.185 -0.461 . . . . 727.09000000000003 110.185 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 tpt -53.53 -45.35 69.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.428 -0.805 . . . . 664.46000000000004 111.806 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.2 mp -60.88 -40.92 94.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.657 0.243 . . . . 447.74000000000001 111.657 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -63.04 -47.2 84.04 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.398 -0.364 . . . . 999.99000000000001 111.758 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 44.8 pt -77.44 -23.05 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.259 0.466 . . . . 398.94999999999999 112.259 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -58.99 -39.24 81.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.464 -0.335 . . . . 366.97000000000003 111.414 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.99 -43.26 99.12 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.665 0.269 . . . . 709.00999999999999 110.753 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -66.0 -45.08 82.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.255 -0.429 . . . . 931.13999999999999 110.758 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 37.8 mm -62.85 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.816 -0.629 . . . . 175.25999999999999 111.327 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -62.04 -43.61 98.46 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.31 -0.404 . . . . 443.19 111.368 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.45 97.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.498 -0.319 . . . . 366.44 111.462 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.15 -40.67 78.07 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.894 0.378 . . . . 386.93000000000001 111.168 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.91 -9.77 75.29 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.053 -0.521 . . . . 244.66999999999999 112.675 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -75.26 147.79 39.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.377 . . . . 999.99000000000001 111.338 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 12.1 p -102.02 106.3 46.92 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 263.29000000000002 110.51 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.11 145.4 49.33 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.628 2.219 . . . . 173.88999999999999 113.473 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.7 m -101.66 -175.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 201.66 111.236 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.61 -40.58 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.333 -0.394 . . . . 81.090000000000003 110.81 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.631 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.09 -40.29 96.92 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.889 -0.672 . . . . 106.63 112.641 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.9 -42.66 80.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.086 0.469 . . . . 397.23000000000002 110.612 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -68.2 -35.49 78.07 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.856 -0.611 . . . . 176.41 112.236 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.631 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -59.8 -34.64 73.3 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.453 0.168 . . . . 224.31999999999999 111.453 -179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.98 -41.16 95.67 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.062 0.458 . . . . 999.99000000000001 109.898 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.22 -39.81 78.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.494 -0.776 . . . . 158.16999999999999 110.265 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -39.52 97.69 Favored Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.421 -0.809 . . . . 65.709999999999994 112.535 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.18 92.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.596 0.236 . . . . 95.379999999999995 110.67 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -64.78 -40.43 95.24 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.102 -0.499 . . . . 381.13999999999999 110.25 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.65 -43.24 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.639 -0.71 . . . . 182.12 110.589 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.72 -22.37 64.07 Favored Glycine 0 CA--C 1.52 0.394 0 CA-C-N 115.895 -0.593 . . . . 88.799999999999997 113.429 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.5 mmt-85 -80.08 -18.56 49.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.896 0.348 . . . . 999.99000000000001 111.191 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.1 mmt85 -108.47 111.98 24.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 999.99000000000001 110.379 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 60.4 mt -124.66 126.17 71.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.844 -0.428 . . . . 308.67000000000002 109.844 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.35 32.23 5.71 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.971 -0.292 . . . . 388.05000000000001 111.633 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 77.7 mtm -70.0 -28.73 65.74 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.556 -0.293 . . . . 360.56999999999999 111.039 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.79 -37.96 80.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.016 -0.538 . . . . 184.22999999999999 110.777 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -59.83 -42.21 93.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.665 -0.698 . . . . 999.99000000000001 110.368 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.94 -46.78 84.53 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.821 -0.627 . . . . 374.13 111.12 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -60.12 -44.37 94.95 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.536 0.208 . . . . 999.99000000000001 110.799 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.21 -42.74 93.18 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.455 -0.339 . . . . 558.87 111.126 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.85 96.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.063 -0.517 . . . . 332.85000000000002 111.574 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.97 -46.22 90.21 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.887 -0.597 . . . . 472.20999999999998 110.852 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.73 -39.31 93.98 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.307 -0.406 . . . . 821.44000000000005 111.352 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.73 -38.91 79.41 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.196 -0.456 . . . . 746.24000000000001 111.879 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -83.09 -11.65 57.8 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.601 -0.272 . . . . 999.99000000000001 111.385 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 54.98 39.89 31.8 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.563 0.539 . . . . 675.44000000000005 111.615 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.2 ttp -107.72 124.0 49.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.337 -0.392 . . . . 999.99000000000001 110.874 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.3 mt -94.11 117.12 67.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.378 -0.374 . . . . 390.38 110.373 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -59.78 142.02 97.89 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.821 2.347 . . . . 243.11000000000001 112.421 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -84.79 119.49 25.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 618.10000000000002 110.403 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -70.07 116.5 10.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 999.99000000000001 111.058 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.702 ' O ' ' HG2' ' A' ' 118' ' ' MET . 3.4 mm? -99.04 129.96 28.45 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.488 . . . . 415.25 111.243 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.1 Cg_exo -58.5 -31.9 95.3 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.733 2.289 . . . . 529.14999999999998 112.565 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -61.22 -40.89 95.68 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.931 0.715 . . . . 516.88 112.931 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . 0.702 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 24.8 ptt? -55.39 -22.46 19.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.551 0.575 . . . . 914.60000000000002 112.551 -178.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.13 -39.09 88.7 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.144 0.497 . . . . 675.30999999999995 110.337 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -67.75 -37.23 81.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.755 -0.657 . . . . 900.95000000000005 111.147 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.2 mt -60.34 -46.25 95.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.761 0.652 . . . . 300.73000000000002 112.761 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -80.46 -9.84 59.75 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.208 -0.597 . . . . 595.28999999999996 111.232 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -87.98 -32.77 18.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.822 0.344 . . . . 999.99000000000001 110.923 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 ptp -77.7 148.32 35.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.032 0.444 . . . . 385.68000000000001 111.855 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 125' ' ' ARG . 42.5 ttm105 -51.96 128.69 37.96 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-N 115.371 -0.831 . . . . 999.99000000000001 111.572 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.19 -35.32 90.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.096 2.531 . . . . 149.59999999999999 112.895 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.13 -24.14 67.76 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.119 -0.491 . . . . 147.02000000000001 112.117 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.73 -0.93 57.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.622 -0.263 . . . . 360.37 111.563 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.2 t -88.0 119.23 70.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.688 0.28 . . . . 187.93000000000001 110.829 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.17 156.98 58.52 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.826 2.351 . . . . 265.38999999999999 112.749 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.408 HG13 ' HG2' ' A' ' 59' ' ' GLN . 93.9 t -118.73 137.45 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.057 -0.52 . . . . 246.78 110.53 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -114.57 129.79 56.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.505 -0.316 . . . . 999.99000000000001 110.425 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -82.69 75.28 9.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.938 0.399 . . . . 495.41000000000003 110.91 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.5 mtm . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.25 -0.881 . . . . 761.34000000000003 110.995 179.767 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.751 0.31 . . . . 375.51999999999998 110.659 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -81.15 156.97 71.52 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.447 . . . . 999.99000000000001 110.829 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.78 139.76 90.04 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.639 2.226 . . . . 436.63 111.933 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -121.86 -51.26 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.868 0.322 . . . . 999.99000000000001 111.868 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -101.02 3.22 41.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.81 0.3 . . . . 999.99000000000001 111.81 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 11' ' ' LEU . 1.8 mm? -57.97 113.62 1.97 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.826 0.346 . . . . 781.60000000000002 111.492 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -114.24 152.07 31.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 216.75 110.969 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.34 -41.72 97.51 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.218 -0.446 . . . . 902.89999999999998 110.557 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.56 -38.79 82.06 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.932 -0.576 . . . . 121.34999999999999 111.405 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -63.08 -37.98 89.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 265.05000000000001 109.876 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.21 -44.07 96.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.855 -0.611 . . . . 524.44000000000005 110.271 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.89 -45.81 97.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.609 -0.723 . . . . 214.56 111.242 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.19 90.63 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.058 -0.519 . . . . 61.909999999999997 111.164 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 85' ' ' TYR . 76.1 mt -62.02 -42.37 99.09 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.35 -0.386 . . . . 321.58999999999997 110.715 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.425 ' O ' HG12 ' A' ' 24' ' ' ILE . 31.7 mmmt -61.98 -39.81 93.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.383 -0.371 . . . . 491.97000000000003 111.353 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 76.4 t -64.0 -46.64 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.669 -0.241 . . . . 179.68000000000001 110.994 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -68.41 -42.72 78.56 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.907 0.384 . . . . 483.12 111.034 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.444 HD13 ' SD ' ' A' ' 58' ' ' MET . 83.6 mt -63.8 -46.73 93.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.728 -0.669 . . . . 120.91 112.432 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 20' ' ' LYS . 30.1 mm -61.02 -45.98 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 121.044 -0.263 . . . . 324.41000000000003 111.058 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.51 92.28 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.768 0.285 . . . . 76.379999999999995 111.768 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.52 -45.25 90.78 Favored Glycine 0 C--N 1.335 0.521 0 C-N-CA 120.938 -0.649 . . . . 59.560000000000002 113.683 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CD1' HG23 ' A' ' 23' ' ' ILE . 46.6 m-85 -73.2 -20.79 60.8 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.017 0.377 . . . . 169.43000000000001 112.017 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.0 t70 -75.9 -38.14 58.07 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.827 -0.17 . . . . 145.09 111.17 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 tpp85 -60.56 -45.82 92.49 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.833 -0.432 . . . . 779.76999999999998 109.833 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.427 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.47 -40.09 98.2 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.761 -0.654 . . . . 72.329999999999998 112.387 178.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.33 -39.46 94.61 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.573 0.225 . . . . 213.66999999999999 111.122 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 28' ' ' ASP . 57.6 t -59.8 -40.09 81.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.137 -0.483 . . . . 275.81999999999999 111.76 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.17 -41.6 93.17 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 111.653 0.242 . . . . 545.0 111.653 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.427 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 7.3 m-90 -80.74 -36.95 31.37 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.687 0.28 . . . . 999.99000000000001 111.49 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.8 mt -64.74 -38.37 90.75 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.536 0.569 . . . . 205.93000000000001 112.536 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -64.13 -18.82 64.8 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.449 0.537 . . . . 557.46000000000004 112.449 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.1 t -84.71 -42.92 17.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.741 0.305 . . . . 284.56999999999999 111.699 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -104.25 11.96 34.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.753 0.311 . . . . 350.44 111.555 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.18 -20.14 68.87 Favored Glycine 0 CA--C 1.517 0.195 0 CA-C-N 116.049 -0.523 . . . . 199.69999999999999 114.359 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -61.31 -40.84 95.67 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.038 0.419 . . . . 999.99000000000001 111.662 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.6 p -113.4 9.99 18.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.911 0.338 . . . . 302.80000000000001 111.911 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.6 tp -71.75 123.35 22.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.986 0.422 . . . . 581.97000000000003 111.946 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.5 m -79.77 157.93 26.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 239.06999999999999 110.454 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 94.2 m -60.93 -44.36 97.34 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.803 0.335 . . . . 192.00999999999999 111.183 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.39 -31.75 52.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.263 -0.426 . . . . 278.44999999999999 112.068 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.92 -41.97 90.7 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.867 0.365 . . . . 316.42000000000002 110.282 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.493 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.7 tttp -62.86 -46.42 87.95 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.808 -0.633 . . . . 470.35000000000002 110.229 178.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.18 -40.72 98.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.395 -0.821 . . . . 369.77999999999997 111.252 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.37 95.71 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.169 -0.469 . . . . 66.790000000000006 111.626 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.25 -39.11 93.28 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.29 -0.414 . . . . 238.30000000000001 112.0 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.493 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 36.3 m-85 -63.5 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.829 -0.434 . . . . 526.92999999999995 109.829 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -62.27 -47.14 85.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.622 -0.717 . . . . 162.88 111.341 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.25 -26.81 23.04 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 C-N-CA 120.5 -0.48 . . . . 139.00999999999999 111.366 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.12 -44.36 96.81 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.859 0.362 . . . . 198.61000000000001 110.307 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtm-85 -64.99 -38.64 91.62 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.875 -0.602 . . . . 999.99000000000001 110.975 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -60.24 -45.39 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.33 -0.395 . . . . 799.64999999999998 109.973 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -59.63 -47.7 84.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.893 -0.594 . . . . 151.58000000000001 110.437 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.444 ' SD ' HD13 ' A' ' 23' ' ' ILE . 18.6 tmm? -59.99 -46.18 90.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 168.43000000000001 111.263 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -62.82 -40.96 99.01 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 112.034 0.383 . . . . 530.55999999999995 112.034 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.9 p -69.91 -39.34 76.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.84 -0.344 . . . . 293.49000000000001 111.476 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -71.98 -42.82 66.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.901 0.381 . . . . 383.72000000000003 110.79 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -62.59 -40.17 96.04 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.83 -0.623 . . . . 497.0 111.961 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.84 -40.81 80.95 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.096 0.406 . . . . 177.0 112.096 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -63.66 -42.24 98.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.691 0.281 . . . . 478.75999999999999 111.03 179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.06 -39.96 68.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.401 -0.363 . . . . 727.09000000000003 111.344 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 tpt -52.53 -43.09 64.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.81 -0.632 . . . . 664.46000000000004 112.16 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.67 -43.54 98.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.675 -0.239 . . . . 447.74000000000001 111.281 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.22 -40.03 78.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.942 0.401 . . . . 999.99000000000001 110.855 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.566 HD13 HD13 ' A' ' 88' ' ' LEU . 96.9 mt -63.14 -44.97 99.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.759 -0.655 . . . . 398.94999999999999 110.64 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.03 -41.81 97.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.017 -0.538 . . . . 366.97000000000003 110.925 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -62.56 -43.14 99.55 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.616 -0.265 . . . . 709.00999999999999 110.873 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.41 -47.46 81.89 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.164 -0.471 . . . . 931.13999999999999 111.136 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.41 -45.75 97.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.186 -0.461 . . . . 175.25999999999999 111.076 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.203 -0.453 . . . . 443.19 111.449 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.46 97.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.375 -0.375 . . . . 366.44 111.716 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.16 -40.99 77.84 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.909 0.385 . . . . 386.93000000000001 111.247 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.72 -8.89 78.19 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 121.155 -0.545 . . . . 244.66999999999999 112.733 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -75.2 145.1 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.74 0.305 . . . . 999.99000000000001 111.354 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 34.8 p -83.88 120.54 75.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.441 -0.345 . . . . 263.29000000000002 110.67 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.98 146.52 37.32 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.498 2.132 . . . . 173.88999999999999 112.987 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 m -102.57 169.84 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 201.66 111.158 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.64 -40.48 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.204 -0.453 . . . . 81.090000000000003 111.205 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.43 -39.07 94.39 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.152 -0.547 . . . . 106.63 112.94 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.77 -40.53 95.48 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.826 0.346 . . . . 397.23000000000002 110.527 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 19' ' ' LEU . 48.9 m-85 -67.92 -40.09 83.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.085 -0.507 . . . . 176.41 111.563 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.3 p -68.26 -34.69 76.65 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.004 -0.278 . . . . 224.31999999999999 111.075 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -62.77 -45.2 93.79 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.958 0.408 . . . . 999.99000000000001 109.985 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 69' ' ' ILE . 86.2 mt -64.16 -41.33 97.19 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.702 -0.681 . . . . 158.16999999999999 110.785 179.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.95 -40.27 99.08 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.992 -0.549 . . . . 65.709999999999994 112.432 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.46 92.78 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.671 0.272 . . . . 95.379999999999995 111.247 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.01 -39.95 90.7 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.099 0.476 . . . . 381.13999999999999 110.734 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.76 -40.05 86.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.545 -0.752 . . . . 182.12 110.943 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.413 ' HA2' ' CE1' ' A' ' 27' ' ' PHE . . . -64.76 -14.14 57.66 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.875 -0.602 . . . . 88.799999999999997 114.162 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -78.25 -22.35 48.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.178 0.489 . . . . 999.99000000000001 111.441 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -109.01 115.43 30.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.899 0.381 . . . . 999.99000000000001 110.842 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.0 pt -131.85 153.04 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 120.876 0.37 . . . . 308.67000000000002 111.225 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.8 p-10 -116.24 20.73 14.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 388.05000000000001 110.703 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.96 -39.36 91.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.556 . . . . 360.56999999999999 111.627 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.26 96.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.895 0.379 . . . . 184.22999999999999 110.634 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -69.08 -40.14 78.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.738 -0.665 . . . . 999.99000000000001 110.53 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.71 -49.08 79.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.005 -0.543 . . . . 374.13 110.73 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -60.52 -48.3 82.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.067 -0.515 . . . . 999.99000000000001 110.869 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.21 -45.91 91.24 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.139 -0.482 . . . . 558.87 111.501 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.9 -40.79 98.63 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.551 -0.295 . . . . 332.85000000000002 111.695 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.474 HD11 ' HD3' ' A' ' 112' ' ' PRO . 61.1 tp -61.35 -47.39 86.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.294 -0.412 . . . . 472.20999999999998 110.573 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -66.71 -39.03 87.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.197 -0.456 . . . . 821.44000000000005 111.017 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.05 -40.63 81.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.92 -0.582 . . . . 746.24000000000001 111.953 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -82.52 -11.38 58.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.626 -0.261 . . . . 999.99000000000001 111.466 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.8 t30 55.01 44.28 28.46 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.189 0.518 . . . . 675.44000000000005 111.699 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 26.5 mmt -117.45 128.74 55.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 999.99000000000001 110.534 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.63 116.6 66.56 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.534 -0.303 . . . . 390.38 110.67 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.474 ' HD3' HD11 ' A' ' 105' ' ' LEU . 73.2 Cg_endo -73.53 154.86 50.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.467 2.112 . . . . 243.11000000000001 112.312 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -81.7 121.43 26.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.774 0.321 . . . . 618.10000000000002 110.231 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -69.26 138.38 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.041 -0.527 . . . . 999.99000000000001 110.846 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 83.4 mt -99.24 112.72 63.82 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 415.25 112.011 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -60.45 -27.58 85.13 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.119 2.546 . . . . 529.14999999999998 111.996 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -60.57 -26.43 66.93 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.119 -0.946 . . . . 516.88 111.556 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 30.8 mmm -57.18 -28.24 62.62 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.443 0.534 . . . . 914.60000000000002 112.443 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -60.2 -44.24 95.27 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.024 -0.361 . . . . 675.30999999999995 110.024 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -67.43 -39.19 85.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.064 -0.516 . . . . 900.95000000000005 110.821 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.51 -45.05 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.164 -0.471 . . . . 300.73000000000002 110.865 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -61.13 -40.11 92.54 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.97 -0.559 . . . . 595.28999999999996 111.288 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -67.37 -33.27 74.87 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.202 0.445 . . . . 999.99000000000001 112.202 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.4 mtp -76.76 129.74 36.72 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.301 0.482 . . . . 385.68000000000001 112.301 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -54.04 147.82 23.84 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 115.537 -0.756 . . . . 999.99000000000001 111.441 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.1 -28.2 86.51 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.758 2.306 . . . . 149.59999999999999 112.522 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.48 -31.32 72.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.168 -0.469 . . . . 147.02000000000001 111.291 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.21 -0.06 57.62 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.073 -0.512 . . . . 360.37 111.696 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.2 t -90.53 115.38 64.03 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.656 0.265 . . . . 187.93000000000001 110.636 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.9 159.46 48.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.786 2.324 . . . . 265.38999999999999 112.773 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -116.59 136.81 52.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 246.78 109.539 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -113.27 120.83 42.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.926 0.394 . . . . 999.99000000000001 111.358 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -84.17 163.37 19.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.825 -0.625 . . . . 495.41000000000003 110.23 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.2 mmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.282 -0.866 . . . . 761.34000000000003 110.685 -179.502 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.6 t . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.684 0.278 . . . . 375.51999999999998 110.7 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -82.27 124.95 77.88 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 999.99000000000001 110.363 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.06 141.16 43.3 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.439 2.093 . . . . 436.63 112.835 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -132.04 148.6 52.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.002 -0.545 . . . . 999.99000000000001 110.467 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 56.33 43.14 26.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.607 0.567 . . . . 999.99000000000001 112.052 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.52 137.02 49.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.268 -0.424 . . . . 781.60000000000002 111.251 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -88.04 104.31 16.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.404 . . . . 216.75 110.316 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -63.33 -39.16 93.77 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.775 -0.648 . . . . 902.89999999999998 112.166 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -41.31 90.72 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.738 0.304 . . . . 121.34999999999999 111.741 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -67.71 -33.91 75.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 265.05000000000001 109.932 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 96.5 mt-10 -64.98 -40.45 94.99 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.737 -0.665 . . . . 524.44000000000005 110.27 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.58 -46.44 96.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 115.955 -0.566 . . . . 214.56 111.037 179.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.45 92.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.927 -0.579 . . . . 61.909999999999997 110.322 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.2 tp -64.11 -39.27 93.67 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.409 -0.814 . . . . 321.58999999999997 110.898 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 98.4 mttt -59.22 -37.08 76.63 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.907 -0.588 . . . . 491.97000000000003 111.671 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.51 -43.76 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 179.68000000000001 110.461 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -68.56 -39.69 80.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.892 0.377 . . . . 483.12 110.554 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.78 -47.4 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.689 -0.687 . . . . 120.91 112.84 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 pt -63.33 -37.39 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 N-CA-C 112.577 0.584 . . . . 324.41000000000003 112.577 -178.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.81 91.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.637 0.256 . . . . 76.379999999999995 111.441 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.43 -41.91 65.89 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.023 -0.608 . . . . 59.560000000000002 113.2 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -73.01 -19.02 61.28 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.731 0.641 . . . . 169.43000000000001 112.731 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -75.01 -36.49 61.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.072 -0.251 . . . . 145.09 111.045 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -63.65 -40.53 97.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.929 0.395 . . . . 779.76999999999998 110.191 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.65 -39.36 97.46 Favored Glycine 0 C--N 1.333 0.384 0 CA-C-N 115.701 -0.681 . . . . 72.329999999999998 112.177 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' SD ' ' A' ' 98' ' ' MET . 83.7 mt -62.63 -40.67 97.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.717 0.294 . . . . 213.66999999999999 110.608 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.7 t -61.38 -42.79 95.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.789 -0.641 . . . . 275.81999999999999 111.36 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 68.5 mttm -61.38 -41.51 97.23 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.532 -0.304 . . . . 545.0 111.418 -179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -70.62 -43.9 68.34 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.287 0.565 . . . . 999.99000000000001 110.211 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 97.2 mt -63.27 -38.97 93.23 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.341 -0.845 . . . . 205.93000000000001 113.163 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -63.9 -18.65 64.42 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.508 0.558 . . . . 557.46000000000004 112.508 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -84.92 -44.99 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 112.031 0.382 . . . . 284.56999999999999 112.031 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -103.28 9.57 38.01 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.773 0.321 . . . . 350.44 111.775 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.99 -21.29 63.45 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.559 0.584 . . . . 199.69999999999999 114.559 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.49 -41.19 96.89 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 117.187 0.494 . . . . 999.99000000000001 111.696 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.7 p -113.69 10.23 17.92 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.911 0.337 . . . . 302.80000000000001 111.911 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.8 tp -71.64 124.58 25.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.126 0.417 . . . . 581.97000000000003 112.126 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.2 m -78.98 158.67 27.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 239.06999999999999 110.305 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -60.91 -44.78 96.68 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.664 0.269 . . . . 192.00999999999999 111.575 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.08 -31.76 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 N-CA-C 112.075 0.398 . . . . 278.44999999999999 112.075 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -64.9 -40.15 94.64 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.536 0.208 . . . . 316.42000000000002 110.82 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 29.3 ttpp -61.37 -45.86 92.61 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.26 -0.427 . . . . 470.35000000000002 110.43 179.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -65.22 -39.66 93.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.045 -0.525 . . . . 369.77999999999997 110.674 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.74 92.65 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.877 -0.602 . . . . 66.790000000000006 111.295 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.42 -38.58 91.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.095 -0.502 . . . . 238.30000000000001 111.785 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.438 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 23.3 m-85 -61.66 -38.96 89.69 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.505 -0.554 . . . . 526.92999999999995 109.505 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -65.29 -41.75 93.82 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.674 -0.694 . . . . 162.88 109.74 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.6 t -62.43 -40.4 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.041 -0.527 . . . . 139.00999999999999 110.339 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -58.86 -39.42 81.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.561 -0.745 . . . . 198.61000000000001 110.963 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.7 mmm-85 -61.77 -42.23 98.72 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.722 -0.217 . . . . 999.99000000000001 110.583 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.35 -40.8 96.58 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.06 0.457 . . . . 799.64999999999998 110.116 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -61.65 -48.18 82.04 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.608 -0.724 . . . . 151.58000000000001 110.93 178.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -60.52 -46.84 88.67 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.828 -0.624 . . . . 168.43000000000001 112.023 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -65.65 -33.54 76.12 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 120.733 -0.387 . . . . 530.55999999999995 111.145 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.0 m -66.1 -45.99 79.22 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.194 0.521 . . . . 293.49000000000001 110.214 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -64.29 -45.29 88.67 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.635 -0.711 . . . . 383.72000000000003 110.445 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -62.73 -43.53 98.56 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.666 -0.697 . . . . 497.0 111.845 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.99 78.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.125 0.417 . . . . 177.0 112.125 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -60.07 -49.75 76.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 478.75999999999999 110.889 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.431 ' O ' HG12 ' A' ' 69' ' ' ILE . 54.4 m-85 -72.17 -37.76 69.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.328 -0.396 . . . . 727.09000000000003 111.658 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -53.0 -46.21 68.22 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.433 0.458 . . . . 664.46000000000004 110.788 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.44 -44.44 96.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.989 -0.551 . . . . 447.74000000000001 111.276 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -66.91 -40.69 87.76 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.582 0.586 . . . . 999.99000000000001 112.582 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.3 pt -79.21 -25.51 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 N-CA-C 112.203 0.446 . . . . 398.94999999999999 112.203 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.52 -41.89 95.32 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.529 0.204 . . . . 366.97000000000003 110.813 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.6 -47.15 86.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.335 -0.393 . . . . 709.00999999999999 110.618 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -63.38 -46.75 85.02 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.928 -0.578 . . . . 931.13999999999999 111.286 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.15 -44.99 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.146 -0.479 . . . . 175.25999999999999 111.162 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -61.24 -43.85 98.21 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.314 -0.403 . . . . 443.19 111.269 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.02 -40.35 97.47 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.517 -0.311 . . . . 366.44 111.402 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.13 -39.57 82.69 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.295 -0.411 . . . . 386.93000000000001 111.253 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.65 -0.04 89.22 Favored Glycine 0 C--N 1.332 0.317 0 CA-C-N 116.0 -0.546 . . . . 244.66999999999999 112.508 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 17.2 mmp_? -75.16 149.7 38.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.907 0.384 . . . . 999.99000000000001 111.227 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.4 p -106.83 101.07 35.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 263.29000000000002 110.807 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 78' ' ' ARG . 43.1 Cg_exo -59.88 142.52 98.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.132 2.555 . . . . 173.88999999999999 112.931 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.428 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 15.7 m -100.26 -176.36 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.988 -0.551 . . . . 201.66 110.971 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.7 t -59.64 -43.46 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.39 -0.368 . . . . 81.090000000000003 111.082 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.11 -39.55 95.96 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.52 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -62.16 -41.28 98.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.896 0.379 . . . . 397.23000000000002 110.72 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.428 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 47.6 m-85 -68.38 -39.95 81.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.968 -0.56 . . . . 176.41 111.416 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.4 p -67.34 -36.0 80.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 111.633 0.234 . . . . 224.31999999999999 111.633 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.61 -47.16 84.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.215 0.531 . . . . 999.99000000000001 110.095 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 tp -67.99 -42.09 81.29 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.575 -0.739 . . . . 158.16999999999999 110.514 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.32 -39.39 97.16 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.763 -0.653 . . . . 65.709999999999994 113.042 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -60.77 -40.76 93.73 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.756 0.312 . . . . 95.379999999999995 110.869 179.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.4 -39.44 93.86 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.097 -0.501 . . . . 381.13999999999999 110.352 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.4 mm -63.9 -42.09 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.628 -0.715 . . . . 182.12 110.758 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -71.17 -9.35 67.11 Favored Glycine 0 CA--C 1.521 0.466 0 CA-C-N 115.842 -0.617 . . . . 88.799999999999997 113.995 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.3 mmm180 -77.72 -25.96 49.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.314 0.557 . . . . 999.99000000000001 111.331 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -108.53 112.15 24.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.891 0.376 . . . . 999.99000000000001 110.681 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 79.0 mt -125.68 125.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 308.67000000000002 110.591 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -137.44 65.67 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.883 0.373 . . . . 388.05000000000001 110.581 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.557 ' SD ' HD23 ' A' ' 31' ' ' LEU . 28.3 ptm -72.38 -21.12 61.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.987 -0.552 . . . . 360.56999999999999 110.755 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.27 89.82 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.886 -0.597 . . . . 184.22999999999999 110.681 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.22 -48.35 82.1 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.796 -0.638 . . . . 999.99000000000001 111.143 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -62.81 -44.06 97.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.354 -0.384 . . . . 374.13 110.301 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -60.67 -47.67 85.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.911 -0.586 . . . . 999.99000000000001 110.539 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.46 -41.68 97.59 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.762 -0.654 . . . . 558.87 111.062 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.07 98.08 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.387 -0.37 . . . . 332.85000000000002 111.209 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.95 -41.09 97.69 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.46 -0.336 . . . . 472.20999999999998 110.598 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -63.0 -44.53 95.77 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.807 -0.633 . . . . 821.44000000000005 111.158 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.78 -39.79 82.11 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.075 -0.512 . . . . 746.24000000000001 112.155 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -91.37 0.19 57.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.562 -0.29 . . . . 999.99000000000001 111.697 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 57.5 36.2 26.68 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.022 0.439 . . . . 675.44000000000005 111.21 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 16.7 mmt -100.19 79.39 2.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.167 0.508 . . . . 999.99000000000001 111.088 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 71.6 mt -93.65 120.67 65.96 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.896 -0.593 . . . . 390.38 110.17 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.91 149.93 66.63 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.366 2.044 . . . . 243.11000000000001 112.504 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -80.11 129.67 34.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 618.10000000000002 110.63 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -69.87 86.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.97 -0.559 . . . . 999.99000000000001 111.199 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.97 149.67 35.96 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 415.25 111.297 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.18 -25.22 65.27 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.737 2.292 . . . . 529.14999999999998 112.322 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -60.63 -45.14 95.17 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.04 -0.527 . . . . 516.88 111.338 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 96.8 mtp -59.99 -40.68 90.01 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.249 -0.432 . . . . 914.60000000000002 109.885 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.28 -40.43 96.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.777 -0.647 . . . . 675.30999999999995 110.374 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -62.97 -42.13 99.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.859 -0.61 . . . . 900.95000000000005 111.179 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.29 -44.49 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.68 0.276 . . . . 300.73000000000002 110.449 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -61.25 -41.81 97.55 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.059 -0.518 . . . . 595.28999999999996 111.346 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -65.63 -33.88 76.93 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.346 -0.388 . . . . 999.99000000000001 111.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.8 mtp -72.57 140.68 48.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 385.68000000000001 111.714 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.409 ' O ' HG23 ' A' ' 129' ' ' VAL . 91.3 mtm180 -52.38 141.3 33.13 Favored Pre-proline 0 C--O 1.234 0.281 0 CA-C-N 115.627 -0.715 . . . . 999.99000000000001 111.237 178.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -60.78 -25.73 81.67 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.677 2.251 . . . . 149.59999999999999 112.548 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.16 80.57 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.029 -0.532 . . . . 147.02000000000001 111.618 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.65 -2.54 57.85 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.339 -0.391 . . . . 360.37 111.934 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 125' ' ' ARG . 60.9 t -93.18 116.1 65.99 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.243 -0.28 . . . . 187.93000000000001 110.243 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.21 151.03 72.22 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.44 2.094 . . . . 265.38999999999999 112.752 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.1 t -109.06 137.43 41.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.913 -0.585 . . . . 246.78 110.134 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.1 141.93 47.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.829 0.347 . . . . 999.99000000000001 110.733 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -83.39 158.83 21.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 495.41000000000003 110.81 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.348 -0.834 . . . . 761.34000000000003 111.139 -179.12 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.7 t . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.919 0.39 . . . . 375.51999999999998 111.089 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -91.52 119.98 68.38 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 999.99000000000001 110.562 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.44 139.38 34.48 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.295 1.996 . . . . 436.63 112.392 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -98.22 -11.33 22.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.963 0.411 . . . . 999.99000000000001 111.292 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -108.85 12.46 25.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 999.99000000000001 111.351 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.81 114.49 2.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.017 0.437 . . . . 781.60000000000002 111.602 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -114.91 126.77 55.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 216.75 110.037 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.54 -39.49 91.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.769 0.319 . . . . 902.89999999999998 110.841 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.77 87.87 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.242 -0.435 . . . . 121.34999999999999 111.412 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -68.23 -32.48 72.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.009 -0.541 . . . . 265.05000000000001 110.108 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -63.08 -41.61 99.46 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.738 -0.665 . . . . 524.44000000000005 109.961 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.12 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 115.803 -0.635 . . . . 214.56 111.033 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.16 -40.87 97.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.232 -0.44 . . . . 61.909999999999997 110.626 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.77 -43.01 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.823 -0.626 . . . . 321.58999999999997 110.312 178.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -59.72 -44.21 93.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.391 -0.822 . . . . 491.97000000000003 111.498 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.66 -42.82 97.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 179.68000000000001 111.69 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -63.9 -41.13 97.78 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.738 0.304 . . . . 483.12 111.177 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.263 -0.426 . . . . 120.91 110.582 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.59 -42.87 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 115.972 -0.558 . . . . 324.41000000000003 111.325 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.49 95.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.743 0.275 . . . . 76.379999999999995 111.743 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.98 -41.28 97.4 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 120.801 -0.714 . . . . 59.560000000000002 112.493 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -73.18 -19.6 61.07 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.726 0.41 . . . . 169.43000000000001 111.504 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -75.64 -34.67 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.315 . . . . 145.09 111.046 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.75 -44.23 96.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.998 0.428 . . . . 779.76999999999998 109.907 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.04 -37.59 94.14 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.533 -0.758 . . . . 72.329999999999998 112.521 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.83 -41.27 78.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.71 0.291 . . . . 213.66999999999999 110.403 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.9 -44.9 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.018 -0.537 . . . . 275.81999999999999 110.779 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 -40.14 95.07 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.756 0.312 . . . . 545.0 110.944 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.6 t90 -64.96 -42.0 94.99 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.315 -0.624 . . . . 999.99000000000001 109.315 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 83.6 mt -62.67 -36.68 83.65 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.332 -0.849 . . . . 205.93000000000001 111.293 179.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.13 -37.72 86.23 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.585 0.217 . . . . 557.46000000000004 111.585 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.2 t -87.01 -50.59 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 113.616 0.969 . . . . 284.56999999999999 113.616 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -99.77 -1.49 37.54 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.083 0.771 . . . . 350.44 113.083 -177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -73.51 -11.87 80.19 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 121.233 -0.508 . . . . 199.69999999999999 114.05 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.54 -41.17 96.95 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.91 0.355 . . . . 999.99000000000001 111.533 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 61.7 p -113.29 5.44 16.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.875 0.369 . . . . 302.80000000000001 111.694 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.4 tp -71.85 133.38 45.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.054 -0.521 . . . . 581.97000000000003 111.3 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -75.89 161.52 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.039 -0.528 . . . . 239.06999999999999 111.266 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.1 -44.54 94.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.998 -0.547 . . . . 192.00999999999999 111.913 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.48 -30.4 47.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.558 0.218 . . . . 278.44999999999999 111.352 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -67.04 -38.12 85.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.47 -0.332 . . . . 316.42000000000002 110.344 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -62.7 -40.41 97.04 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.074 0.464 . . . . 470.35000000000002 110.242 178.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -69.48 -33.01 72.26 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.627 -0.715 . . . . 369.77999999999997 110.784 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.33 76.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.833 -0.621 . . . . 66.790000000000006 111.639 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.0 mt -60.49 -39.18 86.74 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.832 0.308 . . . . 238.30000000000001 111.832 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -63.55 -39.04 93.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.916 -0.402 . . . . 526.92999999999995 109.916 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -70.11 -40.72 74.72 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.758 -0.655 . . . . 162.88 110.449 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.6 t -63.59 -40.49 89.25 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 N-CA-C 109.655 -0.498 . . . . 139.00999999999999 109.655 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -59.34 -39.82 84.41 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.455 -0.793 . . . . 198.61000000000001 110.52 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 ttt-85 -60.69 -47.63 85.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.49 -0.323 . . . . 999.99000000000001 110.625 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.67 -41.26 96.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.139 0.495 . . . . 799.64999999999998 110.552 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -61.89 -47.35 85.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.46 -0.791 . . . . 151.58000000000001 110.905 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.5 ttt -59.81 -48.21 82.62 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.429 -0.805 . . . . 168.43000000000001 112.82 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -66.04 -31.3 72.1 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.149 0.425 . . . . 530.55999999999995 112.149 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.6 m -64.0 -49.72 71.33 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.882 0.372 . . . . 293.49000000000001 110.962 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.5 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 76.1 m-70 -72.56 -36.91 68.34 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.235 -0.439 . . . . 383.72000000000003 111.636 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -60.13 -45.32 93.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.939 -0.573 . . . . 497.0 111.088 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.76 90.85 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.884 0.327 . . . . 177.0 111.884 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -64.44 -42.22 96.11 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.751 0.31 . . . . 478.75999999999999 111.175 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.5 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 38.5 m-85 -70.34 -37.48 74.66 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.245 -0.434 . . . . 727.09000000000003 111.371 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.0 ttp -52.29 -46.12 65.79 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.086 -0.506 . . . . 664.46000000000004 111.722 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.02 -41.49 98.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.462 -0.335 . . . . 447.74000000000001 111.056 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -67.72 -41.59 83.24 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.067 0.46 . . . . 999.99000000000001 110.666 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.46 -45.63 97.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 115.637 -0.71 . . . . 398.94999999999999 111.223 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -61.86 -40.88 96.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.312 -0.404 . . . . 366.97000000000003 111.571 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.77 -42.29 97.82 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.699 0.285 . . . . 709.00999999999999 110.747 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.46 -46.16 87.5 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.08 -0.509 . . . . 931.13999999999999 111.098 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.64 -46.5 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 CA-C-N 116.196 -0.456 . . . . 175.25999999999999 111.111 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.14 -45.3 92.6 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.379 -0.373 . . . . 443.19 111.667 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.56 97.47 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.114 0.413 . . . . 366.44 112.114 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -76.08 -44.36 39.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.865 0.364 . . . . 386.93000000000001 111.334 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.46 -10.82 73.27 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.207 -0.521 . . . . 244.66999999999999 113.132 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -75.34 155.27 36.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.951 0.405 . . . . 999.99000000000001 111.571 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.9 t -93.38 116.95 67.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-N 116.158 -0.473 . . . . 263.29000000000002 110.374 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.27 141.9 40.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.322 2.015 . . . . 173.88999999999999 113.178 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.45 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 17.9 m -102.45 -176.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 201.66 110.976 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 75.3 t -62.68 -41.03 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.904 0.383 . . . . 81.090000000000003 110.112 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.602 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.11 -38.73 94.81 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.795 -0.638 . . . . 106.63 112.39 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -62.02 -40.98 97.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.038 0.447 . . . . 397.23000000000002 110.31 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.45 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 48.5 m-85 -69.18 -38.18 78.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.809 -0.632 . . . . 176.41 111.451 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.7 OUTLIER -64.47 -36.12 83.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 121.074 -0.25 . . . . 224.31999999999999 110.812 -179.736 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.77 -41.25 92.28 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.027 0.441 . . . . 999.99000000000001 110.292 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -66.3 -41.34 89.87 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.733 -0.667 . . . . 158.16999999999999 110.388 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.24 -40.07 98.62 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 115.645 -0.707 . . . . 65.709999999999994 112.417 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.45 -40.56 94.92 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.484 0.183 . . . . 95.379999999999995 111.023 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.13 -40.89 97.15 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.031 0.443 . . . . 381.13999999999999 110.659 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.02 -41.5 92.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.75 -0.659 . . . . 182.12 110.658 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -69.29 -10.04 61.96 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.677 -0.692 . . . . 88.799999999999997 114.093 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 29.0 mmt85 -78.05 -22.25 49.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.404 0.602 . . . . 999.99000000000001 111.299 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -108.42 112.81 25.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.675 0.274 . . . . 999.99000000000001 110.314 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.9 mt -126.28 113.54 34.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.108 -0.33 . . . . 308.67000000000002 110.108 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -111.62 30.1 7.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.334 -0.394 . . . . 388.05000000000001 112.014 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -61.53 -41.33 97.18 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 111.666 0.247 . . . . 360.56999999999999 111.666 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.36 94.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.168 0.509 . . . . 184.22999999999999 110.989 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -65.31 -35.76 81.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.543 -0.753 . . . . 999.99000000000001 111.764 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -58.52 -49.37 77.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.666 0.27 . . . . 374.13 110.987 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -66.09 -38.2 87.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 999.99000000000001 111.499 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.37 -41.12 96.57 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.743 0.306 . . . . 558.87 110.349 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.07 -41.32 97.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.114 -0.494 . . . . 332.85000000000002 111.132 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.97 -40.9 83.09 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.009 -0.541 . . . . 472.20999999999998 111.236 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.18 -39.39 94.52 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.485 -0.325 . . . . 821.44000000000005 110.791 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.18 -41.45 83.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.095 -0.502 . . . . 746.24000000000001 111.322 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -91.46 1.41 57.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 999.99000000000001 111.468 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 58.66 42.21 20.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.058 -0.519 . . . . 675.44000000000005 111.512 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 97.7 mmm -102.57 101.82 12.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 999.99000000000001 110.795 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.4 mm -94.13 119.81 66.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 390.38 110.794 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.45 153.26 55.34 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.606 2.204 . . . . 243.11000000000001 112.434 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -83.91 127.37 33.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.443 -0.344 . . . . 618.10000000000002 110.508 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -69.68 122.73 19.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 999.99000000000001 111.122 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.9 mt -99.69 117.12 64.17 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 415.25 111.589 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.14 -24.0 38.94 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.423 2.082 . . . . 529.14999999999998 112.093 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -65.48 -25.25 67.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.553 -0.749 . . . . 516.88 111.275 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -32.36 49.96 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.018 -0.537 . . . . 914.60000000000002 111.953 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.48 -40.12 90.14 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.821 0.343 . . . . 675.30999999999995 110.799 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.75 -38.48 89.21 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.94 -0.573 . . . . 900.95000000000005 110.872 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.17 -44.95 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.126 -0.488 . . . . 300.73000000000002 110.9 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -60.87 -38.4 85.48 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.415 -0.357 . . . . 595.28999999999996 111.304 179.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -65.48 -33.07 75.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.28 -0.418 . . . . 999.99000000000001 111.154 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 89.7 mmm -70.02 133.58 47.37 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.998 -0.547 . . . . 385.68000000000001 111.605 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.478 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.9 mmp_? -53.34 138.41 48.71 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.972 -0.558 . . . . 999.99000000000001 111.163 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.84 -38.99 85.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.91 2.406 . . . . 149.59999999999999 113.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -65.28 -26.54 68.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.39 -0.368 . . . . 147.02000000000001 111.711 179.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -91.68 -3.47 56.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.433 -0.349 . . . . 360.37 111.799 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 125' ' ' ARG . 59.7 t -91.99 114.99 63.8 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.662 0.268 . . . . 187.93000000000001 110.543 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.24 147.89 60.77 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.279 1.986 . . . . 265.38999999999999 112.344 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.8 m -128.89 153.03 37.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.133 -0.485 . . . . 246.78 110.323 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -128.39 137.28 51.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 999.99000000000001 110.979 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -85.21 175.65 8.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.996 -0.547 . . . . 495.41000000000003 109.907 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.3 -0.857 . . . . 761.34000000000003 110.871 -179.228 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.821 0.343 . . . . 375.51999999999998 111.032 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -87.78 154.62 53.1 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 999.99000000000001 110.758 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.05 152.41 72.96 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.544 2.163 . . . . 436.63 112.298 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -82.12 55.61 2.88 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.168 0.433 . . . . 999.99000000000001 112.168 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 49.53 64.31 1.81 Allowed 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.43 0.456 . . . . 999.99000000000001 111.939 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -55.51 132.38 48.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.08 0.467 . . . . 781.60000000000002 111.482 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -73.19 132.53 43.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.688 -0.687 . . . . 216.75 111.372 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.07 -41.94 97.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.058 -0.519 . . . . 902.89999999999998 111.044 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.53 -39.16 83.02 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.976 0.417 . . . . 121.34999999999999 111.375 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.436 ' CD1' ' HB ' ' A' ' 82' ' ' VAL . 11.9 m-30 -68.45 -34.02 75.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.133 -0.485 . . . . 265.05000000000001 109.968 179.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.39 -40.6 93.66 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.615 -0.721 . . . . 524.44000000000005 111.761 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.625 HG21 ' HA ' ' A' ' 127' ' ' ALA . 9.8 p -69.79 -36.57 70.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 120.777 -0.369 . . . . 214.56 111.378 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -63.78 -42.05 97.82 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 121.102 0.477 . . . . 61.909999999999997 110.477 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.89 -40.86 78.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.603 -0.726 . . . . 321.58999999999997 111.01 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 24' ' ' ILE . 40.2 ttpt -59.63 -45.17 92.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.726 -0.67 . . . . 491.97000000000003 112.559 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.81 -33.14 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 120.861 -0.336 . . . . 179.68000000000001 111.346 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.586 HE22 HG22 ' A' ' 86' ' ' THR . 75.1 mt-30 -66.94 -41.52 86.83 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.14 0.495 . . . . 483.12 110.22 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.05 -42.49 88.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.431 -0.804 . . . . 120.91 110.427 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 mm -60.57 -44.12 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 115.754 -0.657 . . . . 324.41000000000003 111.268 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.34 97.34 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.53 0.205 . . . . 76.379999999999995 111.353 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.37 -41.4 96.54 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 121.005 -0.617 . . . . 59.560000000000002 112.675 179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -71.92 -25.55 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.754 0.311 . . . . 169.43000000000001 111.335 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.1 t0 -76.91 -36.25 56.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 145.09 110.874 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -60.38 -46.59 89.43 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.845 -0.428 . . . . 779.76999999999998 109.845 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.97 -39.27 96.34 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.776 -0.647 . . . . 72.329999999999998 112.038 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 60.8 tp -61.64 -40.48 95.06 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 122.659 0.384 . . . . 213.66999999999999 111.379 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 28' ' ' ASP . 58.8 t -59.51 -44.26 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.762 -0.199 . . . . 275.81999999999999 110.946 -179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.4 -40.78 97.61 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.973 0.416 . . . . 545.0 110.528 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.593 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 72.8 t90 -65.86 -41.66 91.36 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.913 -0.585 . . . . 999.99000000000001 109.961 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.424 ' HA ' ' HA3' ' A' ' 39' ' ' GLY . 87.8 mt -61.25 -36.84 81.08 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.64 -0.709 . . . . 205.93000000000001 111.468 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.72 -37.77 85.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.551 -0.295 . . . . 557.46000000000004 111.296 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.88 -51.16 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 113.53 0.937 . . . . 284.56999999999999 113.53 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -109.95 -22.8 11.67 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.174 0.805 . . . . 350.44 113.174 -177.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 35' ' ' LEU . . . -62.38 -21.39 62.18 Favored Glycine 0 N--CA 1.461 0.335 0 C-N-CA 121.145 -0.55 . . . . 199.69999999999999 113.828 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -62.84 -18.18 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.079 0.4 . . . . 999.99000000000001 112.079 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.0 p -102.81 -6.14 22.88 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.484 0.549 . . . . 302.80000000000001 112.484 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.593 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 95.5 mt -73.42 142.77 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.035 0.445 . . . . 581.97000000000003 111.719 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.3 m -77.6 161.45 27.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.725 -0.67 . . . . 239.06999999999999 110.67 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -41.27 93.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.373 -0.376 . . . . 192.00999999999999 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.805 HG13 ' HB2' ' A' ' 114' ' ' TYR . 58.3 t -65.55 -42.74 93.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.157 -0.474 . . . . 278.44999999999999 110.721 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.665 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 96.5 mt-30 -63.07 -41.14 99.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.007 -0.542 . . . . 316.42000000000002 111.219 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -61.51 -46.69 88.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.262 -0.426 . . . . 470.35000000000002 111.353 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.73 -40.17 91.89 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.85 0.357 . . . . 369.77999999999997 111.383 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.27 -25.27 68.24 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.046 -0.525 . . . . 66.790000000000006 112.214 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 94.0 mt -64.08 -24.37 67.67 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.01 0.744 . . . . 238.30000000000001 113.01 -178.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -60.57 -40.71 92.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 526.92999999999995 110.338 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -70.65 -37.17 73.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.24 -0.436 . . . . 162.88 110.409 178.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.63 -42.89 97.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.685 -0.689 . . . . 139.00999999999999 110.529 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -60.66 -40.13 90.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.94 -0.573 . . . . 198.61000000000001 111.173 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -60.87 -46.52 90.29 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.747 0.308 . . . . 999.99000000000001 110.414 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.42 -38.74 92.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 799.64999999999998 110.706 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.93 -49.01 79.37 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.634 -0.712 . . . . 151.58000000000001 111.685 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ptm -67.63 -37.16 82.07 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 121.065 -0.254 . . . . 168.43000000000001 111.483 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -65.61 -38.0 88.21 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 111.849 0.314 . . . . 530.55999999999995 111.849 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -60.15 -48.17 82.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.72 0.295 . . . . 293.49000000000001 111.006 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -71.34 -40.44 70.69 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.794 0.33 . . . . 383.72000000000003 111.22 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.9 t-105 -62.6 -45.7 91.68 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.418 0.525 . . . . 497.0 112.418 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.25 84.28 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 112.383 0.512 . . . . 177.0 112.383 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -62.02 -48.7 79.1 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.868 0.366 . . . . 478.75999999999999 111.155 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -72.15 -37.39 69.42 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.171 -0.468 . . . . 727.09000000000003 112.193 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 67.2 ttp -52.73 -46.79 67.57 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.396 -0.365 . . . . 664.46000000000004 111.94 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 67' ' ' LEU . 3.1 mm? -63.06 -44.14 96.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.82 -0.173 . . . . 447.74000000000001 111.15 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -63.35 -47.09 83.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.983 0.42 . . . . 999.99000000000001 110.628 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.34 -42.91 98.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 115.694 -0.685 . . . . 398.94999999999999 110.979 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -59.98 -42.06 93.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.232 -0.44 . . . . 366.97000000000003 111.428 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.59 -41.39 98.92 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.938 -0.305 . . . . 709.00999999999999 110.532 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.97 -45.45 92.38 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.043 -0.526 . . . . 931.13999999999999 110.254 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.45 -44.56 99.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.667 -0.697 . . . . 175.25999999999999 110.706 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -61.1 -44.57 97.16 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.111 -0.495 . . . . 443.19 111.138 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.4 97.25 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.426 -0.352 . . . . 366.44 111.409 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.73 -39.65 80.27 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.293 -0.412 . . . . 386.93000000000001 111.291 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.43 77.46 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.178 -0.534 . . . . 244.66999999999999 112.278 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.95 152.61 38.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 999.99000000000001 111.442 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.5 p -117.95 94.48 46.43 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.371 -0.377 . . . . 263.29000000000002 110.476 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -72.12 150.27 53.62 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.762 2.308 . . . . 173.88999999999999 113.331 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.6 m -101.47 173.08 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.703 -0.68 . . . . 201.66 110.536 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 18' ' ' ALA . 9.0 p -56.33 -26.75 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.631 -0.258 . . . . 81.090000000000003 111.643 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.26 -38.66 96.04 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 121.11 -0.567 . . . . 106.63 112.012 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -73.62 -29.07 62.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.037 0.446 . . . . 397.23000000000002 110.698 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -69.16 -24.82 64.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.637 -0.71 . . . . 176.41 112.217 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.586 HG22 HE22 ' A' ' 22' ' ' GLN . 70.2 p -59.29 -35.83 74.48 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.553 0.216 . . . . 224.31999999999999 111.127 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -62.66 -44.9 95.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.034 0.445 . . . . 999.99000000000001 110.052 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -65.44 -41.04 93.9 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.705 -0.679 . . . . 158.16999999999999 110.492 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.17 98.83 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.598 -0.728 . . . . 65.709999999999994 112.652 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.29 -40.14 93.03 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.766 0.317 . . . . 95.379999999999995 111.098 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -65.22 -41.19 94.66 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.173 -0.467 . . . . 381.13999999999999 110.205 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.52 -42.77 96.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 182.12 110.691 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.62 -36.89 92.51 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.785 -0.643 . . . . 88.799999999999997 113.445 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -79.67 -10.87 59.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.196 0.443 . . . . 999.99000000000001 112.196 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -108.37 112.47 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 999.99000000000001 111.03 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.1 pt -131.85 152.09 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.488 -0.324 . . . . 308.67000000000002 111.154 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -155.2 38.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.2 0.524 . . . . 388.05000000000001 109.791 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 24.7 ptp -74.77 -16.19 60.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.665 -0.698 . . . . 360.56999999999999 112.356 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.15 96.62 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.763 0.316 . . . . 184.22999999999999 111.356 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -71.15 -35.19 71.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.355 -0.384 . . . . 999.99000000000001 110.971 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.74 -46.68 89.5 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.09 -0.504 . . . . 374.13 110.624 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 45.1 m-85 -63.45 -40.94 98.47 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.623 -0.262 . . . . 999.99000000000001 110.975 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -63.52 -40.76 97.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.21 -0.45 . . . . 558.87 110.668 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.32 -41.32 98.91 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.945 -0.57 . . . . 332.85000000000002 111.25 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -42.7 99.29 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.253 -0.431 . . . . 472.20999999999998 110.786 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -64.0 -42.33 97.21 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.252 -0.431 . . . . 821.44000000000005 111.082 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.7 -42.65 84.14 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 746.24000000000001 111.791 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -89.41 -3.24 58.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.347 . . . . 999.99000000000001 111.396 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.89 42.95 28.27 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.58 0.55 . . . . 675.44000000000005 111.447 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mtp -99.74 84.2 2.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.211 -0.449 . . . . 999.99000000000001 111.22 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.2 mt -94.43 117.05 67.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 390.38 110.303 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.99 139.96 90.38 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.813 2.342 . . . . 243.11000000000001 112.718 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.61 144.88 28.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 618.10000000000002 110.66 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.805 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.1 t80 -68.55 108.78 3.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.833 0.349 . . . . 999.99000000000001 111.155 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.43 138.57 20.51 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.087 -0.506 . . . . 415.25 110.851 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.03 -33.6 96.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.836 2.357 . . . . 529.14999999999998 112.042 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -61.06 -38.78 87.42 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.393 -0.821 . . . . 516.88 111.472 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 64.4 mtt -60.18 -41.78 93.6 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.785 0.326 . . . . 914.60000000000002 110.532 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -61.88 -42.55 99.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 675.30999999999995 110.622 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.12 -41.08 99.27 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.275 -0.421 . . . . 900.95000000000005 110.935 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.94 -44.32 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.142 -0.481 . . . . 300.73000000000002 110.796 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -38.33 90.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.349 -0.387 . . . . 595.28999999999996 111.704 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.44 -35.11 79.94 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.655 0.613 . . . . 999.99000000000001 112.655 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.5 ptp -90.51 149.38 22.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.035 0.445 . . . . 385.68000000000001 112.175 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.7 mmp_? -53.51 145.61 27.74 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 115.458 -0.792 . . . . 999.99000000000001 111.211 178.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.79 -26.21 81.57 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.948 2.432 . . . . 149.59999999999999 112.87 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.625 ' HA ' HG21 ' A' ' 17' ' ' VAL . . . -62.35 -35.98 80.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 147.02000000000001 111.695 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.73 -1.08 57.88 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.45 -0.341 . . . . 360.37 111.785 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 94.0 t -81.87 121.99 79.71 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 187.93000000000001 110.758 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -68.56 149.1 73.86 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.39 2.06 . . . . 265.38999999999999 112.534 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.71 137.95 55.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.9 -0.591 . . . . 246.78 110.052 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -122.35 136.71 54.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 999.99000000000001 110.875 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.12 171.3 12.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 495.41000000000003 110.45 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.185 -0.912 . . . . 761.34000000000003 111.115 -179.274 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.5 t . . . . . 0 C--O 1.233 0.191 0 N-CA-C 109.904 -0.406 . . . . 375.51999999999998 109.904 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 pm0 -79.16 156.74 76.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 999.99000000000001 110.959 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -68.37 152.14 75.65 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.425 2.083 . . . . 436.63 112.573 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -109.59 151.24 27.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 999.99000000000001 110.399 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -82.14 73.5 9.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 999.99000000000001 111.087 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.96 151.38 14.89 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.608 -0.724 . . . . 781.60000000000002 111.351 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -61.57 129.05 39.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.354 -0.385 . . . . 216.75 110.582 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.74 -39.94 93.33 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.07 -0.514 . . . . 902.89999999999998 111.655 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.03 87.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.013 0.435 . . . . 121.34999999999999 111.422 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -70.52 -34.72 72.62 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 265.05000000000001 110.222 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -67.01 -41.14 87.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.699 -0.682 . . . . 524.44000000000005 112.07 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.787 HG11 ' HA ' ' A' ' 127' ' ' ALA . 30.1 m -73.8 -28.99 25.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 N-CA-C 112.033 0.383 . . . . 214.56 112.033 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.73 93.29 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.222 0.534 . . . . 61.909999999999997 109.892 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.11 -36.06 72.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.279 -0.873 . . . . 321.58999999999997 111.081 178.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.48 ' O ' HG12 ' A' ' 24' ' ' ILE . 64.4 tttm -59.11 -41.93 89.34 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.641 -0.709 . . . . 491.97000000000003 111.712 -178.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.88 -44.6 99.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.584 0.23 . . . . 179.68000000000001 110.99 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -64.71 -43.26 94.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.944 0.402 . . . . 483.12 110.955 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.4 -43.92 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 115.795 -0.639 . . . . 120.91 111.59 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 20' ' ' LYS . 29.9 mm -61.06 -41.23 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 116.373 -0.376 . . . . 324.41000000000003 111.451 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.03 95.05 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.524 0.194 . . . . 76.379999999999995 111.524 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.48 -41.37 98.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.831 -0.699 . . . . 59.560000000000002 112.548 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -74.48 -20.1 60.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.633 0.254 . . . . 169.43000000000001 111.531 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -76.13 -37.27 58.23 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.969 -0.382 . . . . 145.09 109.969 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -63.3 -40.69 98.06 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.103 -0.703 . . . . 779.76999999999998 109.103 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.503 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.81 -37.23 93.96 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.013 -0.994 . . . . 72.329999999999998 112.58 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 82.0 mt -58.76 -36.53 74.52 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.164 0.186 . . . . 213.66999999999999 111.171 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.32 -41.61 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 116.214 -0.448 . . . . 275.81999999999999 111.222 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.52 -42.57 99.01 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.525 0.202 . . . . 545.0 111.381 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.503 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 8.0 m-90 -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.531 0.205 . . . . 999.99000000000001 110.992 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.3 mt -62.78 -37.21 85.75 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.93 0.395 . . . . 205.93000000000001 110.863 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.94 -37.29 86.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.322 -0.399 . . . . 557.46000000000004 111.384 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.66 -51.99 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 113.424 0.898 . . . . 284.56999999999999 113.424 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.93 -21.26 12.73 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.967 0.728 . . . . 350.44 112.967 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.641 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.73 -37.9 93.08 Favored Glycine 0 N--CA 1.46 0.25 0 C-N-CA 121.233 -0.508 . . . . 199.69999999999999 113.325 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -61.71 -20.46 63.52 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.988 0.366 . . . . 999.99000000000001 111.988 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.3 p -105.63 -4.36 21.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.983 0.364 . . . . 302.80000000000001 111.983 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.641 HD12 ' HA2' ' A' ' 39' ' ' GLY . 91.0 mt -72.92 146.28 46.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.084 0.469 . . . . 581.97000000000003 111.63 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.0 m -76.82 164.55 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.808 -0.633 . . . . 239.06999999999999 110.582 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.6 m -59.67 -41.95 91.78 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.346 -0.388 . . . . 192.00999999999999 111.072 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 114' ' ' TYR . 69.5 t -65.87 -42.47 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.26 -0.427 . . . . 278.44999999999999 110.482 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -63.28 -40.59 97.81 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.125 -0.488 . . . . 316.42000000000002 111.16 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -61.38 -46.66 89.27 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.271 -0.422 . . . . 470.35000000000002 110.784 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.58 -39.71 91.94 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.303 -0.408 . . . . 369.77999999999997 111.177 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.27 83.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.722 -0.672 . . . . 66.790000000000006 111.907 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.6 -32.08 49.64 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.77 0.656 . . . . 238.30000000000001 112.77 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -62.93 -42.88 99.94 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.801 0.334 . . . . 526.92999999999995 110.751 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -70.99 -39.27 72.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.196 0.522 . . . . 162.88 109.813 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -60.5 -41.42 87.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.252 -0.885 . . . . 139.00999999999999 111.191 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.68 -45.19 89.97 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.501 0.191 . . . . 198.61000000000001 110.921 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -65.07 -41.59 94.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.747 0.308 . . . . 999.99000000000001 110.747 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -63.9 -40.84 97.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.266 0.555 . . . . 799.64999999999998 110.253 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -58.96 -48.51 81.27 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.282 -0.872 . . . . 151.58000000000001 110.376 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -45.7 92.03 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.729 -0.669 . . . . 168.43000000000001 111.49 179.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.54 -39.65 94.29 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.264 -0.425 . . . . 530.55999999999995 111.689 -179.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.5 m -61.09 -47.06 88.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.985 0.421 . . . . 293.49000000000001 110.776 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.49 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 67.7 m80 -70.12 -38.71 75.65 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.088 -0.505 . . . . 383.72000000000003 111.346 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -60.29 -48.16 82.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.301 -0.409 . . . . 497.0 111.02 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.64 94.19 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 111.843 0.312 . . . . 177.0 111.843 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.85 -48.45 78.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.426 -0.352 . . . . 478.75999999999999 111.727 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.49 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 62.7 m-85 -71.06 -36.38 72.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.524 -0.307 . . . . 727.09000000000003 111.79 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 62.4 ttp -52.42 -44.89 65.67 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.381 0.425 . . . . 664.46000000000004 112.062 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.8 mt -61.45 -42.23 98.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.479 0.18 . . . . 447.74000000000001 111.16 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -68.84 -40.39 79.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 999.99000000000001 110.593 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 88' ' ' LEU . 95.1 mt -63.65 -44.84 98.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.761 -0.654 . . . . 398.94999999999999 110.883 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.69 -39.43 88.46 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.282 -0.417 . . . . 366.97000000000003 111.567 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.28 -48.19 82.8 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.857 0.361 . . . . 709.00999999999999 110.496 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.7 tptm -64.79 -45.11 87.68 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.858 -0.61 . . . . 931.13999999999999 111.092 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 37.4 mm -62.96 -45.8 97.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.028 -0.533 . . . . 175.25999999999999 111.948 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -61.6 -40.46 94.9 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.745 -0.207 . . . . 443.19 110.997 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.5 95.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.345 . . . . 366.44 111.135 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.9 mt -70.06 -39.94 75.36 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.189 -0.46 . . . . 386.93000000000001 111.425 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.9 -8.82 79.26 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 121.107 -0.568 . . . . 244.66999999999999 112.411 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -74.73 152.07 39.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.622 0.249 . . . . 999.99000000000001 111.318 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -115.2 94.36 38.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.51 -0.314 . . . . 263.29000000000002 110.987 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.34 143.23 97.78 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.323 2.682 . . . . 173.88999999999999 113.446 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.429 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 16.2 m -100.76 -177.82 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.842 -0.617 . . . . 201.66 110.607 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.1 t -58.13 -42.48 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-N 116.421 -0.354 . . . . 81.090000000000003 110.88 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -39.47 96.83 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.28 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.21 -38.52 91.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 397.23000000000002 111.428 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 39.3 m-85 -67.91 -26.4 65.97 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.749 0.648 . . . . 176.41 112.749 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -57.14 -34.66 68.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 121.004 -0.278 . . . . 224.31999999999999 111.218 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -65.53 -41.11 93.43 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.954 0.407 . . . . 999.99000000000001 110.484 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 69' ' ' ILE . 86.8 mt -66.93 -40.96 87.75 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.796 -0.638 . . . . 158.16999999999999 110.493 179.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.74 -40.73 99.57 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.626 -0.715 . . . . 65.709999999999994 112.178 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.96 -39.77 93.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.636 0.255 . . . . 95.379999999999995 110.933 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.05 -40.48 94.8 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.254 -0.43 . . . . 381.13999999999999 110.595 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.93 -42.57 96.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.897 -0.592 . . . . 182.12 110.348 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -65.05 -17.33 63.27 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.787 -0.642 . . . . 88.799999999999997 113.437 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -80.09 -13.03 59.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.987 0.394 . . . . 999.99000000000001 111.178 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -107.48 112.1 24.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 999.99000000000001 110.282 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 78.2 mt -125.4 125.95 69.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.292 -0.413 . . . . 308.67000000000002 110.746 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -130.6 48.53 2.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.077 0.465 . . . . 388.05000000000001 110.516 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 67.2 mtt -66.77 -35.54 80.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.654 -0.703 . . . . 360.56999999999999 111.661 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.4 -38.12 79.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.32 -0.4 . . . . 184.22999999999999 111.33 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -59.27 -47.13 86.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.272 -0.422 . . . . 999.99000000000001 110.397 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -58.62 -48.26 81.59 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.106 -0.497 . . . . 374.13 111.249 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 58.1 m-85 -62.81 -41.63 99.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.768 0.318 . . . . 999.99000000000001 110.985 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -64.23 -43.6 94.45 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.076 -0.511 . . . . 558.87 111.224 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.77 -41.36 97.6 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.154 -0.475 . . . . 332.85000000000002 111.721 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.91 -48.48 76.43 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.465 -0.334 . . . . 472.20999999999998 111.08 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.94 -40.21 95.91 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.678 0.275 . . . . 821.44000000000005 111.283 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.62 -44.67 90.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.19 -0.459 . . . . 746.24000000000001 111.959 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -86.53 -11.26 52.13 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.897 0.332 . . . . 999.99000000000001 111.897 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.07 39.94 31.73 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.397 0.435 . . . . 675.44000000000005 111.778 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mmm -109.68 108.8 19.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.871 0.367 . . . . 999.99000000000001 111.483 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.46 120.02 65.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 390.38 110.126 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.61 146.14 54.12 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.279 1.986 . . . . 243.11000000000001 112.754 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -84.94 142.26 29.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 618.10000000000002 110.692 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.51 ' HB2' HG13 ' A' ' 45' ' ' VAL . 78.2 t80 -69.34 109.6 4.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.401 -0.363 . . . . 999.99000000000001 110.969 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.59 126.02 40.64 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.437 -0.347 . . . . 415.25 111.011 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -56.91 -32.63 93.05 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.042 2.495 . . . . 529.14999999999998 112.355 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -59.74 -45.28 92.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.758 -0.655 . . . . 516.88 111.642 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 77.9 mtm -60.16 -40.89 91.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.695 0.283 . . . . 914.60000000000002 110.253 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 55.2 tp10 -60.79 -43.0 98.68 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.976 -0.557 . . . . 675.30999999999995 110.104 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.505 ' O ' ' HG2' ' A' ' 124' ' ' MET . 88.9 tt0 -61.62 -44.74 96.43 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.813 -0.63 . . . . 900.95000000000005 110.973 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.8 mm -61.53 -43.74 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 CA-C-N 116.419 -0.355 . . . . 300.73000000000002 111.392 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -61.8 -38.66 88.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.624 0.25 . . . . 595.28999999999996 111.474 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -66.44 -32.66 74.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.338 -0.392 . . . . 999.99000000000001 111.771 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 120' ' ' GLU . 26.5 mmt -70.43 141.31 52.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.503 -0.317 . . . . 385.68000000000001 111.416 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.499 ' O ' HG23 ' A' ' 129' ' ' VAL . 95.7 mtm-85 -52.26 139.46 35.98 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 115.776 -0.647 . . . . 999.99000000000001 111.044 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -60.44 -25.97 81.7 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.734 2.289 . . . . 149.59999999999999 112.794 -179.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.787 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -62.22 -36.7 82.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 147.02000000000001 111.43 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -92.12 -0.09 57.45 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.191 0.441 . . . . 360.37 112.191 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.0 t -89.59 117.55 68.25 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.692 0.282 . . . . 187.93000000000001 111.305 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -72.83 160.85 45.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.814 2.343 . . . . 265.38999999999999 112.388 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 92.3 t -106.18 137.19 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.936 0.398 . . . . 246.78 110.444 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -96.4 126.94 41.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 999.99000000000001 110.891 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -82.76 149.66 27.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 495.41000000000003 110.15 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.3 mmt . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.471 -0.776 . . . . 761.34000000000003 110.767 -179.718 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.7 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.766 0.317 . . . . 375.51999999999998 111.037 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.29 126.49 60.36 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.967 -0.561 . . . . 999.99000000000001 110.704 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.656 ' HB3' HD12 ' A' ' 11' ' ' LEU . 59.9 Cg_exo -56.55 134.66 65.79 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.712 2.275 . . . . 436.63 112.2 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -125.59 -47.07 1.71 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.465 -0.334 . . . . 999.99000000000001 111.838 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -105.28 -7.79 18.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.327 0.491 . . . . 999.99000000000001 112.327 -178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.656 HD12 ' HB3' ' A' ' 8' ' ' PRO . 92.0 mt -58.81 138.99 56.93 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.886 0.374 . . . . 781.60000000000002 111.573 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -100.3 118.51 36.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 216.75 110.179 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -61.6 -38.94 89.43 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.003 -0.544 . . . . 902.89999999999998 111.643 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.03 87.29 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.856 0.36 . . . . 121.34999999999999 111.396 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -70.07 -30.72 68.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 265.05000000000001 110.03 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -64.38 -39.05 93.11 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.746 -0.661 . . . . 524.44000000000005 109.526 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.31 -44.88 96.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.51 -0.768 . . . . 214.56 111.017 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 21' ' ' VAL . . . -61.89 -38.77 89.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.151 0.501 . . . . 61.909999999999997 110.397 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.6 -39.61 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.759 -0.655 . . . . 321.58999999999997 111.085 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 24' ' ' ILE . 98.1 mttt -60.23 -41.24 92.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.81 0.671 . . . . 491.97000000000003 112.81 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 18' ' ' ALA . 9.9 p -66.03 -36.36 77.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 120.719 -0.393 . . . . 179.68000000000001 111.208 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.432 ' OE1' ' HA ' ' A' ' 86' ' ' THR . 63.1 tt0 -67.02 -39.98 87.15 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.101 0.477 . . . . 483.12 110.249 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.89 -43.52 98.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 115.544 -0.753 . . . . 120.91 110.436 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 20' ' ' LYS . 31.8 mm -60.09 -43.91 93.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-N 115.511 -0.768 . . . . 324.41000000000003 111.775 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.96 95.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.013 0.375 . . . . 76.379999999999995 112.013 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.3 -42.83 95.95 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.731 -0.747 . . . . 59.560000000000002 113.103 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HE1' HG22 ' A' ' 92' ' ' ILE . 38.0 m-85 -74.69 -19.81 60.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.056 0.391 . . . . 169.43000000000001 112.056 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.427 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.7 t0 -76.42 -39.48 53.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.738 -0.21 . . . . 145.09 111.182 -178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -62.55 -43.33 99.08 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.947 0.403 . . . . 779.76999999999998 109.944 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.31 -39.58 94.37 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.691 -0.686 . . . . 72.329999999999998 112.225 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -63.24 -42.56 99.24 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 122.33 0.252 . . . . 213.66999999999999 111.209 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 28' ' ' ASP . 63.0 t -60.94 -46.03 97.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.567 -0.288 . . . . 275.81999999999999 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -63.17 -41.25 99.2 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.848 0.356 . . . . 545.0 110.636 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -63.92 -44.13 93.83 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.337 0.589 . . . . 999.99000000000001 109.978 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.461 HD21 ' HE3' ' A' ' 47' ' ' LYS . 61.7 tp -60.77 -39.07 87.43 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.104 -0.953 . . . . 205.93000000000001 111.42 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -64.4 -25.01 67.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.907 0.336 . . . . 557.46000000000004 111.907 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.3 t -86.81 -51.06 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 N-CA-C 113.128 0.788 . . . . 284.56999999999999 113.128 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.653 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.1 m-70 -98.98 -4.03 33.56 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.737 0.643 . . . . 350.44 112.737 -178.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.49 -34.9 70.16 Favored Glycine 0 N--CA 1.46 0.289 0 CA-C-N 116.169 -0.468 . . . . 199.69999999999999 114.086 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -62.26 -19.91 63.71 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.098 0.407 . . . . 999.99000000000001 112.098 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.492 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.2 p -111.69 -13.06 13.8 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.792 0.664 . . . . 302.80000000000001 112.792 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 95.1 mt -72.96 137.27 45.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.804 0.335 . . . . 581.97000000000003 111.815 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.5 p -78.04 165.47 23.98 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.305 -0.407 . . . . 239.06999999999999 110.359 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.8 m -61.76 -44.15 97.45 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.771 0.319 . . . . 192.00999999999999 111.188 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.627 HG13 ' HB2' ' A' ' 114' ' ' TYR . 70.6 t -66.91 -43.69 89.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.219 -0.446 . . . . 278.44999999999999 111.035 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 64.9 tt0 -63.11 -40.78 98.62 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.453 . . . . 316.42000000000002 111.12 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HE3' HD21 ' A' ' 35' ' ' LEU . 87.8 tttt -60.36 -47.12 87.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.311 -0.404 . . . . 470.35000000000002 111.241 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.88 -40.38 95.02 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.906 0.384 . . . . 369.77999999999997 110.914 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.68 86.13 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.711 -0.677 . . . . 66.790000000000006 111.647 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 83.9 mt -60.61 -35.63 76.61 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.899 0.703 . . . . 238.30000000000001 112.899 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -59.67 -41.24 90.16 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.969 -0.382 . . . . 526.92999999999995 109.969 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -68.69 -39.41 80.53 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.217 -0.447 . . . . 162.88 109.898 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.446 HG11 ' CE2' ' A' ' 101' ' ' PHE . 57.4 t -60.32 -41.29 86.64 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 CA-C-N 115.877 -0.601 . . . . 139.00999999999999 110.442 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -59.11 -42.43 90.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.427 -0.351 . . . . 198.61000000000001 110.394 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.655 ' O ' ' HG2' ' A' ' 58' ' ' MET . 98.7 mtt180 -64.77 -42.54 95.04 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.18 -0.464 . . . . 999.99000000000001 110.439 178.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -65.31 -42.71 92.72 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.496 0.665 . . . . 799.64999999999998 110.633 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -60.59 -47.02 88.05 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.96 -1.018 . . . . 151.58000000000001 111.865 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 55' ' ' ARG . 14.0 ptt? -58.98 -39.27 81.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.745 0.307 . . . . 168.43000000000001 110.852 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.453 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 98.3 mm-40 -69.63 -39.05 77.39 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.189 -0.46 . . . . 530.55999999999995 111.2 179.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.7 m -61.44 -48.01 83.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.288 -0.414 . . . . 293.49000000000001 110.959 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.6 -48.53 79.0 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.083 -0.508 . . . . 383.72000000000003 110.827 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.4 t-105 -64.85 -40.24 94.84 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.912 0.708 . . . . 497.0 112.912 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.93 -37.9 72.13 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.915 0.709 . . . . 177.0 112.915 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.68 -46.97 87.46 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.674 0.273 . . . . 478.75999999999999 110.977 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -77.83 -41.1 38.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.418 -0.355 . . . . 727.09000000000003 111.127 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.6 ttt -53.6 -45.02 69.88 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.013 0.745 . . . . 664.46000000000004 113.013 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.2 tp -57.81 -45.46 86.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.014 0.375 . . . . 447.74000000000001 112.014 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -65.56 -40.87 93.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 999.99000000000001 111.172 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mm -70.63 -42.97 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.115 -0.493 . . . . 398.94999999999999 111.082 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -60.66 -38.9 86.41 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.805 -0.634 . . . . 366.97000000000003 111.925 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.22 -46.33 88.76 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 110.261 -0.274 . . . . 709.00999999999999 110.261 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.79 -41.28 92.18 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.357 -0.383 . . . . 931.13999999999999 111.071 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.05 -45.69 98.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.381 -0.372 . . . . 175.25999999999999 110.998 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.85 -43.1 99.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.175 -0.466 . . . . 443.19 111.124 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.51 -40.26 96.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.348 -0.387 . . . . 366.44 111.09 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.58 -38.54 80.78 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.169 -0.469 . . . . 386.93000000000001 111.343 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.7 5.02 75.16 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.952 -0.642 . . . . 244.66999999999999 112.48 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -74.18 147.56 42.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.867 0.365 . . . . 999.99000000000001 111.269 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -102.9 109.39 61.23 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 263.29000000000002 110.812 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -59.43 138.44 84.17 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.746 2.297 . . . . 173.88999999999999 112.549 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.9 m -102.37 172.61 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.447 . . . . 201.66 111.692 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.3 t -61.16 -41.13 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 115.68 -0.691 . . . . 81.090000000000003 110.97 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.02 -41.88 98.14 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.782 -0.723 . . . . 106.63 112.398 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.84 -40.13 94.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.128 0.489 . . . . 397.23000000000002 110.216 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -66.63 -39.88 88.48 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.517 -0.765 . . . . 176.41 111.591 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.9 OUTLIER -64.22 -34.33 77.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.988 -0.285 . . . . 224.31999999999999 111.025 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.73 -40.99 92.74 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.212 0.529 . . . . 999.99000000000001 109.593 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.98 -38.61 86.38 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.327 -0.851 . . . . 158.16999999999999 110.476 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.99 -39.18 95.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.621 -0.718 . . . . 65.709999999999994 113.067 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.7 97.12 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.895 0.379 . . . . 95.379999999999995 110.2 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.4 -40.39 89.58 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.839 -0.619 . . . . 381.13999999999999 110.363 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.437 HG22 ' HE1' ' A' ' 27' ' ' PHE . 97.3 mt -61.61 -45.6 98.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.729 -0.669 . . . . 182.12 111.321 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -81.9 -2.56 90.59 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.937 -0.649 . . . . 88.799999999999997 113.64 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -79.45 -30.67 42.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.123 0.461 . . . . 999.99000000000001 110.953 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -108.63 112.65 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.512 -0.313 . . . . 999.99000000000001 110.937 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.7 mm -124.89 125.55 69.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.585 -0.524 . . . . 308.67000000000002 109.585 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -141.76 68.97 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.894 0.378 . . . . 388.05000000000001 111.582 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.3 mmm -70.97 -28.21 64.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.86 -0.609 . . . . 360.56999999999999 111.192 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.21 -38.16 82.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.66 -0.7 . . . . 184.22999999999999 112.031 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -59.24 -48.8 80.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.4 -0.363 . . . . 999.99000000000001 111.135 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.446 ' CE2' HG11 ' A' ' 53' ' ' VAL . 83.3 t80 -60.01 -46.81 88.26 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.585 -0.279 . . . . 374.13 110.962 179.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -58.44 -47.44 83.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.037 -0.529 . . . . 999.99000000000001 111.141 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.7 -46.08 91.75 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.578 -0.283 . . . . 558.87 110.804 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.16 98.08 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.256 -0.429 . . . . 332.85000000000002 111.378 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.49 -45.23 93.96 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.981 -0.554 . . . . 472.20999999999998 110.956 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -62.75 -39.31 93.71 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.243 -0.435 . . . . 821.44000000000005 110.782 179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.13 -40.95 82.61 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.962 -0.563 . . . . 746.24000000000001 111.39 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -83.41 -11.73 57.25 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.316 -0.402 . . . . 999.99000000000001 111.518 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.5 t30 54.06 45.99 26.39 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 122.96 0.504 . . . . 675.44000000000005 111.781 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.4 mtp -107.91 113.85 27.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.881 0.372 . . . . 999.99000000000001 111.361 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.8 mt -94.33 118.73 67.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 390.38 110.185 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.66 139.51 34.11 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.307 2.005 . . . . 243.11000000000001 112.97 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -86.07 141.27 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 618.10000000000002 110.692 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.627 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.8 t80 -68.66 119.93 13.86 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.714 0.292 . . . . 999.99000000000001 110.615 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -98.59 123.83 48.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.47 -0.332 . . . . 415.25 111.322 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -57.83 -31.74 93.19 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.953 2.435 . . . . 529.14999999999998 112.449 178.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -61.24 -28.17 68.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.696 -0.684 . . . . 516.88 111.702 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.06 -37.66 80.53 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.337 -0.392 . . . . 914.60000000000002 111.093 -179.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.58 -40.32 91.28 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 675.30999999999995 110.933 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.27 -40.55 96.22 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.475 -0.329 . . . . 900.95000000000005 110.978 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.2 mm -61.43 -45.72 98.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.152 -0.477 . . . . 300.73000000000002 110.673 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -39.1 93.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.817 -0.628 . . . . 595.28999999999996 111.995 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 54.8 mmm-85 -67.72 -34.25 76.49 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.973 0.731 . . . . 999.99000000000001 112.973 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.2 ptp -81.3 151.02 28.25 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.129 0.49 . . . . 385.68000000000001 112.252 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -51.75 134.52 36.54 Favored Pre-proline 0 N--CA 1.466 0.353 0 CA-C-N 115.285 -0.87 . . . . 999.99000000000001 111.457 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -53.12 -32.59 59.94 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.303 2.668 . . . . 149.59999999999999 113.171 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.07 -36.25 76.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 147.02000000000001 111.663 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -91.87 8.14 38.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.453 -0.34 . . . . 360.37 111.736 -179.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 72.8 t -91.43 114.78 62.87 Favored Pre-proline 0 C--O 1.234 0.244 0 CA-C-O 120.818 0.342 . . . . 187.93000000000001 110.965 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.46 157.59 49.02 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.676 2.251 . . . . 265.38999999999999 112.772 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.453 ' HB ' ' HG3' ' A' ' 59' ' ' GLN . 16.7 m -126.84 158.82 37.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.074 -0.512 . . . . 246.78 110.593 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -113.98 128.94 56.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.881 0.372 . . . . 999.99000000000001 111.297 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -83.17 161.62 21.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.928 -0.578 . . . . 495.41000000000003 109.985 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.173 -0.918 . . . . 761.34000000000003 110.687 -179.411 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 40.4 ttp-105 . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.951 0.405 . . . . 999.99000000000001 111.896 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -142.47 152.21 42.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 999.99000000000001 110.666 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -153.06 162.25 41.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.308 -0.405 . . . . 999.99000000000001 109.91 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -108.15 140.07 41.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.454 -0.339 . . . . 999.99000000000001 110.344 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -85.48 108.25 17.81 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.009 0.433 . . . . 999.99000000000001 110.291 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 61.6 t -125.08 127.42 72.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.901 -0.59 . . . . 375.51999999999998 110.031 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -91.11 116.1 65.74 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.682 -0.236 . . . . 999.99000000000001 110.418 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HA ' ' OD1' ' A' ' 74' ' ' ASP . 59.9 Cg_endo -72.4 140.2 33.04 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.503 2.135 . . . . 436.63 112.783 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -99.68 -12.7 19.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 999.99000000000001 111.17 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -107.98 10.79 28.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 999.99000000000001 111.087 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.3 tp -57.05 124.62 19.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.856 -0.611 . . . . 781.60000000000002 111.909 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.522 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.5 t-20 -109.98 110.34 21.23 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.311 -0.626 . . . . 216.75 109.311 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.08 -39.34 92.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.294 0.479 . . . . 902.89999999999998 112.294 -178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.83 -41.21 90.83 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 111.95 0.352 . . . . 121.34999999999999 111.95 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -72.56 -27.71 62.38 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.411 -0.358 . . . . 265.05000000000001 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 12' ' ' ASN . 78.2 mm-40 -63.97 -40.04 95.51 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.104 -0.498 . . . . 524.44000000000005 112.115 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 14' ' ' ALA . 9.3 p -67.27 -36.07 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 120.757 -0.377 . . . . 214.56 110.938 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.84 -42.61 99.81 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.195 0.521 . . . . 61.909999999999997 109.98 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.6 tp -66.08 -42.68 89.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.23 -0.895 . . . . 321.58999999999997 110.758 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.16 -41.75 93.45 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.588 -0.733 . . . . 491.97000000000003 111.603 -179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' VAL . 65.7 t -63.15 -43.09 98.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 116.61 -0.268 . . . . 179.68000000000001 111.067 -179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -64.08 -40.97 97.41 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.884 0.374 . . . . 483.12 110.564 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -64.58 -43.92 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 115.829 -0.623 . . . . 120.91 111.025 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.3 mt -61.02 -44.16 97.64 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-N 116.124 -0.489 . . . . 324.41000000000003 111.388 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.13 -43.52 95.63 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.58 0.229 . . . . 76.379999999999995 111.222 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.78 -39.39 96.59 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 121.146 -0.549 . . . . 59.560000000000002 112.435 178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -72.38 -20.59 61.42 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.6 0.36 . . . . 169.43000000000001 111.718 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -78.1 -23.57 47.89 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 121.183 -0.207 . . . . 145.09 111.535 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' VAL . 95.6 mtt-85 -65.48 -42.48 92.17 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.089 0.471 . . . . 779.76999999999998 110.026 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.4 -25.14 73.58 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.722 -0.672 . . . . 72.329999999999998 112.636 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 64.0 tp -63.09 -44.68 95.05 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.592 0.234 . . . . 213.66999999999999 111.248 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.565 ' HA ' HD12 ' A' ' 35' ' ' LEU . 10.0 p -66.41 -31.73 54.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 116.462 -0.335 . . . . 275.81999999999999 111.137 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.51 -40.58 95.9 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.971 0.415 . . . . 545.0 110.258 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 54.3 t90 -67.07 -38.94 86.66 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.706 -0.679 . . . . 999.99000000000001 109.292 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 32' ' ' VAL . 92.5 mt -61.37 -36.34 79.97 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 115.029 -0.987 . . . . 205.93000000000001 111.298 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.8 mtt-85 -65.5 -21.27 66.61 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.058 0.392 . . . . 557.46000000000004 112.058 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 63.6 t -86.43 -47.59 16.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 112.521 0.563 . . . . 284.56999999999999 112.521 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.14 17.23 21.84 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.279 0.474 . . . . 350.44 112.279 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.81 -39.29 96.6 Favored Glycine 0 CA--C 1.518 0.239 0 N-CA-C 114.446 0.538 . . . . 199.69999999999999 114.446 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.2 ptt180 -63.27 -26.32 68.72 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.492 0.553 . . . . 999.99000000000001 112.492 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.543 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.1 p -113.15 8.11 18.15 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.96 0.356 . . . . 302.80000000000001 111.96 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.4 tp -72.39 121.98 20.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.805 0.336 . . . . 581.97000000000003 111.535 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 80.6 p -80.78 169.24 17.84 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.385 -0.371 . . . . 239.06999999999999 110.258 178.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.3 m -62.38 -43.96 97.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.741 0.305 . . . . 192.00999999999999 111.209 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -28.42 31.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 112.539 0.57 . . . . 278.44999999999999 112.539 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 15.0 mm100 -62.71 -39.45 94.08 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 111.42 0.155 . . . . 316.42000000000002 111.42 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -60.57 -46.84 88.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.86 0.362 . . . . 470.35000000000002 110.202 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.91 -38.6 86.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.872 -0.604 . . . . 369.77999999999997 110.794 179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.05 -37.01 81.11 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.662 -0.699 . . . . 66.790000000000006 111.496 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.4 mt -60.88 -36.41 79.12 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.158 -0.474 . . . . 238.30000000000001 111.796 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -61.07 -39.49 90.1 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.372 -0.603 . . . . 526.92999999999995 109.372 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -65.97 -40.94 91.71 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.619 -0.719 . . . . 162.88 109.603 177.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.42 HG13 ' CE2' ' A' ' 101' ' ' PHE . 55.3 t -61.57 -41.97 92.28 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 CA-C-N 115.729 -0.669 . . . . 139.00999999999999 110.448 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -59.49 -41.65 90.33 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.927 -0.579 . . . . 198.61000000000001 110.821 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.2 -41.95 96.84 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.068 -0.253 . . . . 999.99000000000001 110.619 178.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -64.79 -40.23 94.9 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.29 0.567 . . . . 799.64999999999998 109.982 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -60.42 -46.62 89.37 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.083 -0.962 . . . . 151.58000000000001 110.234 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ttt -59.11 -43.65 91.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.772 -0.649 . . . . 168.43000000000001 110.795 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -62.72 -42.61 99.74 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.799 0.333 . . . . 530.55999999999995 110.993 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.1 m -68.32 -42.89 78.7 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.22 0.533 . . . . 293.49000000000001 110.861 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.419 ' NE2' ' HE1' ' A' ' 65' ' ' TYR . 71.7 t60 -63.27 -38.74 92.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.512 -0.767 . . . . 383.72000000000003 110.759 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -55.95 -32.66 64.04 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.893 -0.594 . . . . 497.0 112.553 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.74 -38.68 78.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.637 0.256 . . . . 177.0 111.681 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -63.4 -43.46 97.45 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.897 0.379 . . . . 478.75999999999999 111.73 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.419 ' HE1' ' NE2' ' A' ' 61' ' ' HIS . 76.8 m-85 -84.74 -20.45 31.07 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.706 0.632 . . . . 727.09000000000003 112.706 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.7 ttt -50.92 -50.19 58.16 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.568 0.581 . . . . 664.46000000000004 112.568 -178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 87.3 mt -64.6 -41.9 95.92 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 111.9 0.333 . . . . 447.74000000000001 111.9 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -71.26 -52.76 17.15 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.398 0.888 . . . . 999.99000000000001 113.398 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 85.1 mt -84.85 -60.09 2.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 114.752 1.39 . . . . 398.94999999999999 114.752 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.23 -42.19 99.21 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 114.373 1.249 . . . . 366.97000000000003 114.373 -175.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 67' ' ' LEU . 40.2 ttpt -62.22 -45.91 91.24 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.739 -0.384 . . . . 709.00999999999999 111.297 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -65.13 -42.43 93.86 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.92 0.341 . . . . 931.13999999999999 111.92 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 91.2 mt -62.88 -46.78 95.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-O 120.628 0.251 . . . . 175.25999999999999 111.203 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 36.6 t70 -63.0 -45.6 91.63 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.355 -0.384 . . . . 443.19 111.468 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.01 -40.63 96.78 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.069 0.396 . . . . 366.44 112.069 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.4 mt -69.14 -39.18 79.0 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.319 . . . . 386.93000000000001 111.522 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.03 -3.47 84.55 Favored Glycine 0 CA--C 1.518 0.27 0 C-N-CA 120.844 -0.693 . . . . 244.66999999999999 112.311 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -74.15 149.87 40.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.826 0.346 . . . . 999.99000000000001 111.036 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.0 p -112.63 95.31 32.03 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.338 -0.392 . . . . 263.29000000000002 111.059 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.86 146.08 98.06 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.061 2.507 . . . . 173.88999999999999 112.463 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.92 -179.54 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.232 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.1 t -59.69 -42.33 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.28 -0.418 . . . . 81.090000000000003 111.157 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.563 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.58 -40.45 97.87 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.682 -0.771 . . . . 106.63 112.143 179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.81 -40.95 96.05 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.902 0.382 . . . . 397.23000000000002 110.718 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -68.55 -37.69 80.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.868 -0.605 . . . . 176.41 112.278 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.563 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -61.48 -35.15 76.84 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.917 -0.313 . . . . 224.31999999999999 111.077 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.2 mmm180 -66.75 -40.65 88.39 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.171 0.51 . . . . 999.99000000000001 110.092 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.46 -38.89 88.34 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.499 -0.773 . . . . 158.16999999999999 110.585 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.65 -39.04 96.01 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.536 -0.756 . . . . 65.709999999999994 112.615 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.07 96.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.617 0.246 . . . . 95.379999999999995 110.802 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -66.25 -41.67 89.66 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.98 0.419 . . . . 381.13999999999999 110.335 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.01 -43.41 97.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 115.931 -0.577 . . . . 182.12 110.796 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -79.08 -2.05 86.42 Favored Glycine 0 CA--C 1.519 0.342 0 CA-C-N 116.022 -0.535 . . . . 88.799999999999997 113.43 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -77.38 -31.34 54.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.874 0.369 . . . . 999.99000000000001 110.709 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -103.48 112.55 25.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.838 0.351 . . . . 999.99000000000001 110.152 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.5 mt -128.18 124.01 61.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.367 -0.379 . . . . 308.67000000000002 110.059 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -140.46 70.96 1.36 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.887 0.375 . . . . 388.05000000000001 111.097 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 61.8 mtt -70.31 -28.17 64.96 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.969 -0.559 . . . . 360.56999999999999 111.19 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.24 82.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.918 -0.583 . . . . 184.22999999999999 111.285 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -59.52 -47.82 84.03 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.241 -0.436 . . . . 999.99000000000001 110.83 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.42 ' CE2' HG13 ' A' ' 53' ' ' VAL . 43.4 t80 -60.29 -47.76 84.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.345 -0.389 . . . . 374.13 110.304 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -59.83 -47.87 83.96 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.765 -0.652 . . . . 999.99000000000001 111.154 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -60.84 -46.7 89.53 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.41 -0.359 . . . . 558.87 111.255 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.83 98.69 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.459 -0.337 . . . . 332.85000000000002 111.388 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.6 tp -64.25 -44.27 92.29 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.077 -0.51 . . . . 472.20999999999998 110.783 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -63.68 -41.91 98.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.673 -0.694 . . . . 821.44000000000005 110.952 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.83 -42.83 85.18 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.09 -0.504 . . . . 746.24000000000001 112.171 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -88.43 -7.9 55.85 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 121.173 -0.211 . . . . 999.99000000000001 111.493 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.04 39.04 31.43 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.081 0.771 . . . . 675.44000000000005 113.081 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.15 61.26 1.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.882 0.373 . . . . 999.99000000000001 110.743 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.0 mt -82.13 121.7 79.01 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.222 -0.445 . . . . 390.38 110.699 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.94 152.73 63.44 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.563 2.176 . . . . 243.11000000000001 112.548 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -74.79 136.3 41.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 618.10000000000002 110.767 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -69.58 90.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.02 -0.536 . . . . 999.99000000000001 110.963 179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.16 145.36 29.87 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.009 -0.541 . . . . 415.25 111.564 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -66.06 -30.28 47.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.555 2.17 . . . . 529.14999999999998 112.35 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -63.29 -45.48 91.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.102 -0.499 . . . . 516.88 110.185 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 98.1 mtp -62.36 -40.24 95.75 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.927 -0.579 . . . . 914.60000000000002 110.164 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -61.26 -41.6 97.19 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.535 -0.757 . . . . 675.30999999999995 110.535 179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.22 -39.42 93.93 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.838 -0.619 . . . . 900.95000000000005 110.883 179.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 90.0 mt -61.51 -44.0 97.84 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 116.086 -0.506 . . . . 300.73000000000002 110.872 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -63.08 -36.38 83.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.215 -0.448 . . . . 595.28999999999996 111.147 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -70.54 -16.12 62.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 999.99000000000001 112.229 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 75.1 mtm -69.93 140.07 53.01 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 120.973 -0.291 . . . . 385.68000000000001 110.811 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 129' ' ' VAL . 59.6 ttp180 -51.41 129.82 33.57 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.857 -0.611 . . . . 999.99000000000001 111.367 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -53.15 -34.74 70.18 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.383 2.722 . . . . 149.59999999999999 113.326 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.44 -35.51 76.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 147.02000000000001 111.838 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -91.11 0.48 57.53 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.946 0.35 . . . . 360.37 111.946 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 125' ' ' ARG . 58.4 t -98.19 111.11 58.72 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.715 0.293 . . . . 187.93000000000001 111.138 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.39 151.03 82.24 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.084 2.523 . . . . 265.38999999999999 112.301 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.98 142.72 32.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.984 0.421 . . . . 246.78 110.704 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -132.78 148.14 52.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.91 -0.586 . . . . 999.99000000000001 110.557 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -83.99 173.92 10.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 495.41000000000003 110.349 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 97.1 mmm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.237 -0.887 . . . . 761.34000000000003 110.921 -178.94 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 112.412 0.523 . . . . 999.99000000000001 112.412 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.3 m -145.11 155.29 43.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.932 0.396 . . . . 999.99000000000001 111.535 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -116.09 147.42 41.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.033 -0.53 . . . . 999.99000000000001 110.794 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -97.5 8.58 44.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 999.99000000000001 111.002 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.5 m-85 -108.93 -100.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.253 -0.43 . . . . 999.99000000000001 110.484 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.2 t -126.89 127.84 70.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.437 -0.209 . . . . 375.51999999999998 110.437 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -81.76 129.25 65.9 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.599 -0.273 . . . . 999.99000000000001 110.311 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.73 130.03 15.28 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.315 2.01 . . . . 436.63 113.258 -179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -124.84 1.69 8.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 999.99000000000001 110.918 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -104.73 8.93 35.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.372 -0.376 . . . . 999.99000000000001 111.81 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.3 mt -56.78 113.7 1.76 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.893 0.378 . . . . 781.60000000000002 111.767 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -114.37 115.01 26.65 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.722 -0.473 . . . . 216.75 109.722 179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -61.7 -39.76 92.59 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.474 -0.33 . . . . 902.89999999999998 111.74 -179.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -40.41 89.34 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.968 0.413 . . . . 121.34999999999999 111.644 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -71.35 -31.39 67.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.095 -0.502 . . . . 265.05000000000001 110.492 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -65.14 -41.19 95.03 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.824 -0.626 . . . . 524.44000000000005 112.016 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.749 HG11 ' HA ' ' A' ' 127' ' ' ALA . 18.7 m -73.99 -29.83 26.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.731 -0.388 . . . . 214.56 111.455 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.92 -40.04 95.56 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.561 0.696 . . . . 61.909999999999997 109.262 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HA3' ' A' ' 89' ' ' GLY . 61.2 tp -64.64 -39.64 94.06 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.712 -1.131 . . . . 321.58999999999997 111.082 178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 98.2 mttt -59.58 -40.5 87.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.191 -0.459 . . . . 491.97000000000003 111.155 -179.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.537 ' O ' HG22 ' A' ' 24' ' ' ILE . 77.6 t -65.42 -44.32 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.879 0.371 . . . . 179.68000000000001 111.199 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -66.12 -42.23 89.47 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.775 0.657 . . . . 483.12 112.775 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 19' ' ' LEU . 44.0 pt -81.42 -27.64 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 113.394 0.887 . . . . 120.91 113.394 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.537 HG22 ' O ' ' A' ' 21' ' ' VAL . 11.2 tt -58.43 -35.73 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.534 0.207 . . . . 324.41000000000003 111.513 -178.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.66 92.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 76.379999999999995 111.237 179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.57 -41.74 89.47 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.158 -0.544 . . . . 59.560000000000002 112.828 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 37.8 m-85 -71.17 -24.97 62.34 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.635 0.235 . . . . 169.43000000000001 111.635 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.434 ' O ' HG23 ' A' ' 32' ' ' VAL . 34.7 t70 -75.45 -38.84 59.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.719 -0.219 . . . . 145.09 110.899 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -62.58 -41.28 98.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.924 0.392 . . . . 779.76999999999998 110.01 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.81 -39.97 96.99 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.732 -0.667 . . . . 72.329999999999998 112.275 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' PHE . 86.4 mt -64.59 -38.81 92.3 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.466 0.173 . . . . 213.66999999999999 111.466 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 28' ' ' ASP . 60.6 t -60.25 -46.0 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.67 -0.241 . . . . 275.81999999999999 110.878 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -63.59 -40.59 97.33 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.052 0.454 . . . . 545.0 110.389 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CH2' HD11 ' A' ' 42' ' ' LEU . 87.3 t90 -64.49 -42.24 95.97 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.695 -0.684 . . . . 999.99000000000001 110.279 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.9 mt -61.98 -36.94 82.99 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.816 -0.629 . . . . 205.93000000000001 111.296 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -61.6 -37.61 84.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.708 0.29 . . . . 557.46000000000004 111.275 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.4 t -87.35 -50.51 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 N-CA-C 113.378 0.881 . . . . 284.56999999999999 113.378 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.576 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.13 -29.46 8.93 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.251 0.834 . . . . 350.44 113.251 -177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.56 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.7 -35.09 84.93 Favored Glycine 0 N--CA 1.462 0.37 0 CA-C-N 116.588 -0.278 . . . . 199.69999999999999 113.793 -178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -58.2 -39.49 79.11 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.961 0.356 . . . . 999.99000000000001 111.961 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 69.9 p -87.3 -10.15 53.06 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.749 0.648 . . . . 302.80000000000001 112.749 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 98.0 mt -73.39 150.98 41.36 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.134 0.492 . . . . 581.97000000000003 111.963 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 66.4 m -77.08 162.79 27.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.673 . . . . 239.06999999999999 110.565 178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.5 m -59.9 -41.13 90.99 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.216 -0.447 . . . . 192.00999999999999 111.187 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.431 ' CG1' ' HB2' ' A' ' 114' ' ' TYR . 77.8 t -65.64 -41.71 91.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.27 -0.423 . . . . 278.44999999999999 110.642 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.94 -39.84 95.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.085 -0.507 . . . . 316.42000000000002 110.913 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -61.83 -44.25 97.22 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.238 -0.437 . . . . 470.35000000000002 110.789 179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.99 -39.31 93.84 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.277 -0.42 . . . . 369.77999999999997 110.92 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -23.89 66.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.777 -0.647 . . . . 66.790000000000006 112.149 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.8 mt -61.2 -37.36 82.7 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 112.285 0.476 . . . . 238.30000000000001 112.285 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -59.01 -46.94 86.93 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.157 -0.683 . . . . 526.92999999999995 109.157 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -62.21 -44.23 97.04 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.422 -0.808 . . . . 162.88 110.421 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.4 t -61.15 -42.46 93.38 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 CA-C-N 116.451 -0.341 . . . . 139.00999999999999 110.492 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.45 -40.33 90.78 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.229 -0.441 . . . . 198.61000000000001 111.051 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -61.15 -46.96 88.38 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.001 -0.37 . . . . 999.99000000000001 110.001 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -64.73 -39.37 93.52 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.375 0.607 . . . . 799.64999999999998 110.21 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' A' ' 96' ' ' ILE . 90.9 t80 -58.36 -47.75 82.81 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.121 -0.945 . . . . 151.58000000000001 110.586 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.0 ttt -60.48 -45.24 94.48 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 168.43000000000001 110.816 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.66 ' HG2' HG13 ' A' ' 131' ' ' VAL . 53.0 mt-30 -62.32 -39.26 92.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.891 -0.595 . . . . 530.55999999999995 111.653 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.9 m -60.51 -48.24 82.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.397 -0.365 . . . . 293.49000000000001 110.976 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.478 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 82.7 m-70 -70.22 -39.13 75.29 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.425 -0.352 . . . . 383.72000000000003 111.204 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 72.1 t-105 -61.4 -45.43 94.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.966 -0.561 . . . . 497.0 111.452 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.28 87.56 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 111.729 0.27 . . . . 177.0 111.729 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -62.78 -46.08 89.66 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.928 0.394 . . . . 478.75999999999999 111.129 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.478 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 48.9 m-85 -70.68 -33.82 71.32 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.137 -0.483 . . . . 727.09000000000003 111.761 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 1.8 mmt -49.09 -41.33 35.31 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.909 0.707 . . . . 664.46000000000004 112.909 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.4 mt -61.96 -43.91 97.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.718 0.294 . . . . 447.74000000000001 111.111 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 47.7 m0 -70.17 -43.93 69.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 999.99000000000001 111.051 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.472 ' O ' HG12 ' A' ' 73' ' ' ILE . 97.2 mt -63.65 -47.92 89.08 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 115.619 -0.719 . . . . 398.94999999999999 111.922 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -62.55 -40.64 97.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.317 -0.401 . . . . 366.97000000000003 111.685 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.7 -46.8 89.0 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.671 -0.24 . . . . 709.00999999999999 110.918 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -65.85 -41.79 91.28 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.555 -0.293 . . . . 931.13999999999999 111.529 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.9 mm -65.16 -46.38 91.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.491 -0.322 . . . . 175.25999999999999 111.04 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -62.99 -43.61 98.31 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.269 -0.423 . . . . 443.19 111.783 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.26 97.0 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.459 -0.337 . . . . 366.44 111.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.2 mp -75.66 -42.62 50.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.028 0.442 . . . . 386.93000000000001 111.012 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 92.89 -14.69 64.56 Favored Glycine 0 CA--C 1.518 0.234 0 CA-C-N 115.845 -0.616 . . . . 244.66999999999999 112.431 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -75.57 139.06 41.88 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.596 0.236 . . . . 999.99000000000001 110.85 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 68.7 p -75.36 139.4 71.7 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.747 -0.206 . . . . 263.29000000000002 110.653 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -73.47 142.56 33.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.423 2.082 . . . . 173.88999999999999 112.924 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.532 HG23 ' H ' ' A' ' 84' ' ' ASP . 18.6 m -102.87 171.42 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.092 -0.503 . . . . 201.66 111.095 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 76.8 t -60.78 -42.52 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.305 -0.407 . . . . 81.090000000000003 110.52 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.38 -39.31 96.02 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.957 -0.64 . . . . 106.63 112.234 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.532 ' H ' HG23 ' A' ' 81' ' ' VAL . 38.1 t70 -61.51 -42.04 98.21 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.826 0.346 . . . . 397.23000000000002 110.178 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 28.2 m-85 -62.96 -41.78 99.63 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.935 -0.575 . . . . 176.41 111.226 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 77.2 p -68.03 -36.37 79.82 Favored 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 111.847 0.314 . . . . 224.31999999999999 111.847 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.9 -41.66 95.41 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.032 0.444 . . . . 999.99000000000001 110.15 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.5 mt -69.37 -39.02 78.29 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.629 -0.714 . . . . 158.16999999999999 110.205 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.52 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.19 -36.73 93.41 Favored Glycine 0 C--N 1.333 0.365 0 CA-C-N 115.176 -0.92 . . . . 65.709999999999994 113.175 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.9 85.08 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-O 120.427 0.156 . . . . 95.379999999999995 111.209 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.97 -40.66 96.35 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.969 0.414 . . . . 381.13999999999999 110.252 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.3 mt -64.53 -43.58 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 115.828 -0.624 . . . . 182.12 110.545 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.411 ' HA2' ' CZ ' ' A' ' 27' ' ' PHE . . . -64.44 -22.45 67.62 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.719 -0.673 . . . . 88.799999999999997 113.95 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -80.2 -14.2 58.63 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 117.034 0.417 . . . . 999.99000000000001 111.489 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.75 115.38 29.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.632 0.253 . . . . 999.99000000000001 110.866 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.492 ' HA ' ' OH ' ' A' ' 57' ' ' TYR . 43.4 pt -129.78 147.44 33.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.996 0.427 . . . . 308.67000000000002 111.241 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -148.08 34.98 0.82 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.0 -0.546 . . . . 388.05000000000001 110.976 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.9 mmm -61.95 -39.5 92.32 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.189 -0.46 . . . . 360.56999999999999 111.382 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.76 -38.7 88.98 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.174 -0.466 . . . . 184.22999999999999 111.104 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -68.94 -30.94 69.49 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.756 -0.656 . . . . 999.99000000000001 111.666 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.78 -49.65 76.88 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.751 0.31 . . . . 374.13 110.833 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -66.87 -37.14 83.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.462 -0.335 . . . . 999.99000000000001 111.309 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.97 -44.46 97.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.415 -0.357 . . . . 558.87 110.385 179.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.18 -41.65 99.24 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.029 -0.532 . . . . 332.85000000000002 111.114 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.05 -41.49 90.74 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.07 -0.514 . . . . 472.20999999999998 110.754 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -62.55 -41.12 98.69 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.119 -0.491 . . . . 821.44000000000005 110.65 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.56 -40.2 78.36 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.975 -0.557 . . . . 746.24000000000001 111.314 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -87.2 -4.42 59.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.313 -0.403 . . . . 999.99000000000001 111.04 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 57.64 39.85 27.15 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.851 -0.613 . . . . 675.44000000000005 111.428 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 98.7 mmm -108.36 114.25 27.95 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.424 -0.353 . . . . 999.99000000000001 111.321 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.1 mt -94.44 118.99 66.96 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.229 -0.441 . . . . 390.38 109.831 179.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.72 126.72 12.31 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.019 1.812 . . . . 243.11000000000001 113.053 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -87.11 156.41 19.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.768 -0.651 . . . . 618.10000000000002 110.774 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.431 ' HB2' ' CG1' ' A' ' 45' ' ' VAL . 75.4 t80 -67.27 125.92 27.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.025 -0.361 . . . . 999.99000000000001 110.025 178.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 87.3 mt -98.62 138.08 20.71 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.535 -0.302 . . . . 415.25 111.363 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.84 -23.17 55.48 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.655 2.237 . . . . 529.14999999999998 111.861 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -63.84 -30.17 71.29 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.559 -0.746 . . . . 516.88 110.822 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.6 mtt -60.13 -39.16 85.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.962 -0.563 . . . . 914.60000000000002 110.66 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -61.09 -40.87 95.35 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.215 -0.448 . . . . 675.30999999999995 110.69 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.27 -41.11 97.07 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.137 -0.483 . . . . 900.95000000000005 111.069 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.98 -44.53 99.05 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.351 -0.386 . . . . 300.73000000000002 110.816 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -62.54 -39.63 94.22 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.392 -0.367 . . . . 595.28999999999996 111.632 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -68.01 -33.43 74.6 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.206 0.447 . . . . 999.99000000000001 112.206 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -83.33 130.45 35.06 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.08 0.4 . . . . 385.68000000000001 112.08 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -53.6 145.66 28.41 Favored Pre-proline 0 N--CA 1.465 0.287 0 CA-C-N 115.731 -0.668 . . . . 999.99000000000001 111.117 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -60.35 -27.47 84.92 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.609 2.206 . . . . 149.59999999999999 112.618 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.749 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -71.07 -19.75 62.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 147.02000000000001 111.29 178.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -103.5 12.69 34.79 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.334 -0.394 . . . . 360.37 111.194 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 58.4 t -98.82 110.43 57.33 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.834 0.35 . . . . 187.93000000000001 110.696 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -76.94 166.59 26.58 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.091 2.527 . . . . 265.38999999999999 112.957 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.66 HG13 ' HG2' ' A' ' 59' ' ' GLN . 64.7 t -107.37 136.33 42.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.047 -0.723 . . . . 246.78 109.047 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -115.67 131.11 57.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.875 0.369 . . . . 999.99000000000001 110.191 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -76.53 158.58 31.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.304 0.573 . . . . 495.41000000000003 112.21 -178.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 74.3 mmm . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.264 -0.874 . . . . 761.34000000000003 111.526 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 112.731 0.641 . . . . 999.99000000000001 112.731 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m -118.96 13.7 13.11 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.488 0.551 . . . . 999.99000000000001 112.488 -178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -112.6 38.91 2.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.911 0.386 . . . . 999.99000000000001 111.491 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.8 m80 57.49 -125.78 1.72 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.563 -0.744 . . . . 999.99000000000001 111.751 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -108.53 13.63 25.2 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 111.705 0.261 . . . . 999.99000000000001 111.705 -179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.8 t -100.58 115.43 42.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.086 0.47 . . . . 375.51999999999998 110.456 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -89.82 119.61 69.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.948 -0.569 . . . . 999.99000000000001 110.217 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -57.99 137.76 82.54 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.537 2.158 . . . . 436.63 112.386 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.4 tptm -106.81 -67.1 0.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.434 -0.348 . . . . 999.99000000000001 111.601 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -105.43 4.27 30.5 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.024 0.379 . . . . 999.99000000000001 112.024 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.64 125.25 22.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.58 -0.282 . . . . 781.60000000000002 110.957 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.9 t-20 -99.53 112.02 24.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.811 0.339 . . . . 216.75 110.632 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -61.89 -39.67 92.76 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.795 -0.639 . . . . 902.89999999999998 111.354 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -38.81 80.03 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.367 -0.379 . . . . 121.34999999999999 111.983 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -64.09 -36.06 82.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.414 -0.357 . . . . 265.05000000000001 110.123 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 79.2 mm-40 -64.87 -40.39 95.04 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.921 -0.581 . . . . 524.44000000000005 110.078 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.4 -47.65 92.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 115.654 -0.703 . . . . 214.56 111.631 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.36 -40.67 97.18 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.038 -0.528 . . . . 61.909999999999997 111.049 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.763 HD22 ' HB3' ' A' ' 85' ' ' TYR . 60.1 tp -65.57 -41.74 92.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.903 -0.59 . . . . 321.58999999999997 111.615 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' O ' HG12 ' A' ' 24' ' ' ILE . 57.1 mtmt -60.24 -38.64 84.06 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.589 -0.278 . . . . 491.97000000000003 111.488 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.4 t -63.39 -43.68 98.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.635 0.255 . . . . 179.68000000000001 110.349 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -65.7 -40.39 92.23 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.365 -0.38 . . . . 483.12 110.708 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.85 -42.41 94.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 115.94 -0.573 . . . . 120.91 110.915 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 20' ' ' LYS . 26.9 mm -60.07 -42.79 91.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.069 -0.514 . . . . 324.41000000000003 111.328 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.29 -42.97 96.6 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 111.559 0.207 . . . . 76.379999999999995 111.559 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.98 -44.3 96.15 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.744 -0.741 . . . . 59.560000000000002 112.848 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -73.03 -20.41 61.0 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.77 0.285 . . . . 169.43000000000001 111.77 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -75.63 -39.54 57.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.041 -0.355 . . . . 145.09 110.041 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -63.95 -42.0 97.43 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.328 -0.619 . . . . 779.76999999999998 109.328 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.469 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -64.53 -39.78 97.1 Favored Glycine 0 CA--C 1.52 0.374 0 CA-C-N 115.551 -0.749 . . . . 72.329999999999998 112.282 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.425 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 66.5 tp -59.19 -46.3 88.78 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.181 0.437 . . . . 213.66999999999999 112.181 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.57 -27.08 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 120.835 -0.346 . . . . 275.81999999999999 111.883 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -63.86 -40.71 97.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.826 0.346 . . . . 545.0 110.937 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 2.7 m-90 -78.4 -31.77 48.44 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.773 0.321 . . . . 999.99000000000001 111.184 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 91.7 mt -63.02 -39.81 95.88 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.2 -0.454 . . . . 205.93000000000001 111.681 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.7 ptt180 -71.04 -19.31 62.51 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.886 0.328 . . . . 557.46000000000004 111.886 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.3 t -85.84 -44.88 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 120.734 0.302 . . . . 284.56999999999999 111.767 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -100.46 9.62 42.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.758 0.313 . . . . 350.44 111.547 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.25 -19.63 70.53 Favored Glycine 0 CA--C 1.52 0.387 0 CA-C-N 116.127 -0.488 . . . . 199.69999999999999 114.199 -179.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.552 ' HG3' HG23 ' A' ' 41' ' ' THR . 52.0 ptt85 -64.15 -34.42 78.02 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.177 0.488 . . . . 999.99000000000001 112.226 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.552 HG23 ' HG3' ' A' ' 40' ' ' ARG . 58.5 p -114.05 -0.13 14.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.855 0.359 . . . . 302.80000000000001 111.79 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -72.31 124.95 26.17 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.972 -0.558 . . . . 581.97000000000003 111.836 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.9 m -77.82 158.91 29.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 239.06999999999999 110.705 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -60.67 -43.35 97.76 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.871 0.367 . . . . 192.00999999999999 111.203 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.604 HG13 ' HB2' ' A' ' 114' ' ' TYR . 67.3 t -66.62 -41.65 88.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.096 -0.502 . . . . 278.44999999999999 110.824 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 97.1 mt-30 -62.95 -39.54 94.96 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.967 -0.56 . . . . 316.42000000000002 111.511 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.05 -47.32 86.37 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.627 0.251 . . . . 470.35000000000002 111.105 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -65.21 -39.55 92.94 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.848 0.356 . . . . 369.77999999999997 110.858 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.92 86.55 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 115.838 -0.619 . . . . 66.790000000000006 111.363 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 87.0 mt -61.31 -36.42 80.06 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.042 -0.527 . . . . 238.30000000000001 112.244 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -59.54 -41.17 89.45 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.676 -0.49 . . . . 526.92999999999995 109.676 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -67.26 -41.44 85.54 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.864 -0.607 . . . . 162.88 110.039 178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -61.79 -42.94 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 CA-C-N 115.97 -0.559 . . . . 139.00999999999999 110.502 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -60.07 -42.78 95.29 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.078 -0.51 . . . . 198.61000000000001 110.539 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -63.32 -42.67 99.0 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.328 -0.396 . . . . 999.99000000000001 110.567 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -63.95 -43.08 96.88 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.138 0.494 . . . . 799.64999999999998 110.242 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -60.32 -47.35 86.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.335 -0.848 . . . . 151.58000000000001 110.51 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttp -60.0 -44.16 94.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.666 -0.697 . . . . 168.43000000000001 110.851 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.62 -41.51 99.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.113 -0.494 . . . . 530.55999999999995 110.976 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.0 m -62.5 -47.06 85.6 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.287 -0.415 . . . . 293.49000000000001 111.231 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -64.37 -47.07 80.66 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.041 -0.527 . . . . 383.72000000000003 110.75 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -62.82 -47.73 82.14 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.345 0.498 . . . . 497.0 112.345 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -38.79 78.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.784 0.661 . . . . 177.0 112.784 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -58.99 -50.36 74.38 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 121.223 -0.191 . . . . 478.75999999999999 111.341 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -73.02 -41.06 64.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.731 0.3 . . . . 727.09000000000003 111.209 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.4 tmm? -54.71 -47.32 73.87 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.709 -0.678 . . . . 664.46000000000004 112.327 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.3 mt -61.35 -41.09 96.49 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 111.928 0.344 . . . . 447.74000000000001 111.928 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.6 t90 -62.51 -47.9 81.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 999.99000000000001 111.494 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.6 tt -78.47 -32.19 16.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 112.621 0.6 . . . . 398.94999999999999 112.621 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -60.95 -41.5 96.42 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.63 0.252 . . . . 366.97000000000003 111.225 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -60.68 -45.98 92.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 709.00999999999999 110.254 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -65.17 -43.03 93.02 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.907 -0.588 . . . . 931.13999999999999 111.474 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 94.0 mt -63.34 -46.36 95.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-O 120.785 0.326 . . . . 175.25999999999999 111.394 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -62.45 -45.1 94.62 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.168 -0.469 . . . . 443.19 111.27 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.3 95.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.438 -0.346 . . . . 366.44 111.81 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -68.48 -38.48 81.05 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.557 -0.292 . . . . 386.93000000000001 111.502 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.22 6.92 70.64 Favored Glycine 0 CA--C 1.518 0.259 0 C-N-CA 120.772 -0.728 . . . . 244.66999999999999 112.465 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 30.9 mmm180 -74.04 151.23 40.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.846 0.355 . . . . 999.99000000000001 110.981 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.7 p -114.91 95.08 40.4 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 263.29000000000002 111.238 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -72.31 155.79 55.53 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.731 2.287 . . . . 173.88999999999999 112.66 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.5 m -100.3 175.49 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 201.66 111.445 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.0 t -60.19 -40.88 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.147 -0.479 . . . . 81.090000000000003 111.193 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.4 -39.69 95.13 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.842 -0.694 . . . . 106.63 112.475 -179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -62.31 -40.18 95.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.022 0.439 . . . . 397.23000000000002 110.347 179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.763 ' HB3' HD22 ' A' ' 19' ' ' LEU . 42.8 m-85 -68.47 -39.19 81.48 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.68 -0.691 . . . . 176.41 111.838 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.9 p -66.42 -29.66 69.85 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.835 0.309 . . . . 224.31999999999999 111.835 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -63.57 -42.14 98.35 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.01 0.433 . . . . 999.99000000000001 110.056 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.26 -41.0 74.05 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.812 -0.631 . . . . 158.16999999999999 110.493 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.09 -40.4 99.17 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.417 -0.811 . . . . 65.709999999999994 112.95 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.44 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.57 -41.97 98.16 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.432 0.158 . . . . 95.379999999999995 111.301 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.93 -41.86 97.51 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.936 0.398 . . . . 381.13999999999999 110.55 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 92.8 mt -65.27 -42.9 95.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.768 -0.651 . . . . 182.12 110.912 179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.32 -20.92 65.88 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 116.019 -0.537 . . . . 88.799999999999997 113.544 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 95.7 mtt-85 -79.44 -17.54 54.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.916 0.358 . . . . 999.99000000000001 111.42 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -108.71 110.93 22.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.885 0.374 . . . . 999.99000000000001 110.88 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.8 mt -129.39 125.55 62.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.831 -0.433 . . . . 308.67000000000002 109.831 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -122.46 51.56 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.976 0.417 . . . . 388.05000000000001 110.999 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 28.4 ptm -91.96 -9.73 41.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.123 -0.49 . . . . 360.56999999999999 111.837 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.07 -40.47 95.91 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.837 0.351 . . . . 184.22999999999999 111.753 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -70.06 -28.24 65.28 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.465 . . . . 999.99000000000001 111.247 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -58.2 -46.57 85.58 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.339 -0.391 . . . . 374.13 111.217 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.608 0.242 . . . . 999.99000000000001 111.11 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.5 -45.3 69.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.349 -0.387 . . . . 558.87 110.908 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.17 96.07 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.98 -0.554 . . . . 332.85000000000002 111.816 -179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.1 tp -60.38 -47.89 84.13 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.421 -0.354 . . . . 472.20999999999998 110.83 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -64.27 -40.25 95.61 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.272 -0.422 . . . . 821.44000000000005 111.102 178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -59.09 -39.05 80.99 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.001 -0.545 . . . . 746.24000000000001 112.16 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -83.0 -11.94 57.69 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 111.66 0.244 . . . . 999.99000000000001 111.66 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.8 t30 52.56 48.64 22.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.027 0.441 . . . . 675.44000000000005 111.391 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 19.2 mmt -122.98 102.67 8.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.369 -0.378 . . . . 999.99000000000001 110.84 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.2 mt -93.93 117.57 67.21 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.492 -0.322 . . . . 390.38 110.326 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.36 149.48 50.78 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.439 2.093 . . . . 243.11000000000001 112.846 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -84.59 147.16 27.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.096 -0.502 . . . . 618.10000000000002 110.227 179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.604 ' HB2' HG13 ' A' ' 45' ' ' VAL . 76.5 t80 -66.77 123.04 19.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.851 0.358 . . . . 999.99000000000001 110.689 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 85.6 mt -98.89 120.73 57.97 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.083 -0.508 . . . . 415.25 111.447 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.67 -28.45 81.62 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.025 2.484 . . . . 529.14999999999998 112.37 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -60.49 -29.0 68.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.704 -0.68 . . . . 516.88 111.709 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 66.6 mtt -60.01 -39.21 85.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.568 -0.287 . . . . 914.60000000000002 110.758 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -61.41 -40.72 95.42 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.176 -0.465 . . . . 675.30999999999995 110.936 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -62.12 -44.38 96.76 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.174 -0.466 . . . . 900.95000000000005 110.966 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.5 mm -62.51 -45.09 99.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.353 -0.385 . . . . 300.73000000000002 111.11 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -63.09 -40.89 98.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.251 -0.431 . . . . 595.28999999999996 112.007 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -66.35 -33.71 76.33 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.383 0.512 . . . . 999.99000000000001 112.383 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.8 mtm -80.25 136.98 36.56 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.789 0.328 . . . . 385.68000000000001 111.665 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.496 ' O ' HG23 ' A' ' 129' ' ' VAL . 77.3 mtp85 -53.4 144.12 32.9 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 115.815 -0.63 . . . . 999.99000000000001 111.165 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -52.89 -33.95 63.89 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.233 2.622 . . . . 149.59999999999999 113.061 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.79 -36.37 78.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 147.02000000000001 111.809 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.45 -0.51 57.63 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.972 0.36 . . . . 360.37 111.972 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.9 t -91.7 114.61 62.48 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 120.705 0.288 . . . . 187.93000000000001 111.022 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.04 157.9 50.3 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.653 2.235 . . . . 265.38999999999999 112.352 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 m -120.61 155.89 23.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.299 -0.41 . . . . 246.78 110.761 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -98.26 119.59 37.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.025 0.441 . . . . 999.99000000000001 111.381 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -84.37 155.69 22.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.767 -0.651 . . . . 495.41000000000003 109.911 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.261 -0.876 . . . . 761.34000000000003 111.051 -179.67 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 23.1 ttt-85 . . . . . 0 N--CA 1.464 0.24 0 N-CA-C 110.004 -0.369 . . . . 999.99000000000001 110.004 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 m -84.11 74.34 10.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.891 0.377 . . . . 999.99000000000001 110.365 179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 5.8 t-105 -108.15 -178.38 3.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.148 -0.478 . . . . 999.99000000000001 110.614 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.475 ' CE1' ' HB ' ' A' ' 6' ' ' VAL . 11.3 t-160 -66.92 135.99 54.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.324 -0.398 . . . . 999.99000000000001 110.354 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -105.74 8.15 32.81 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 111.805 0.298 . . . . 999.99000000000001 111.805 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.475 ' HB ' ' CE1' ' A' ' 4' ' ' HIS . 65.2 t -113.2 121.9 66.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.903 0.382 . . . . 375.51999999999998 110.413 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -80.99 156.07 72.38 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.266 -0.424 . . . . 999.99000000000001 110.986 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.32 151.37 65.84 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.464 2.109 . . . . 436.63 112.323 179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.52 ' HG3' ' CD1' ' A' ' 10' ' ' PHE . 22.5 tptm -104.0 123.57 47.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.259 -0.428 . . . . 999.99000000000001 110.305 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.52 ' CD1' ' HG3' ' A' ' 9' ' ' LYS . 75.3 m-85 59.01 39.4 23.53 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.575 0.547 . . . . 999.99000000000001 111.683 -179.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 60.4 tp -56.99 120.02 7.26 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.869 0.366 . . . . 781.60000000000002 111.278 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -114.3 123.35 49.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.322 -0.399 . . . . 216.75 110.154 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -61.87 -39.48 92.06 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.399 -0.364 . . . . 902.89999999999998 111.213 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.75 -38.41 81.66 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.144 -0.48 . . . . 121.34999999999999 111.616 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -71.25 -25.48 62.49 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 265.05000000000001 111.438 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.08 -40.11 96.71 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.276 -0.42 . . . . 524.44000000000005 112.115 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -72.82 -27.19 24.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 120.782 -0.367 . . . . 214.56 111.633 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.87 93.73 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 121.326 0.584 . . . . 61.909999999999997 109.631 178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.405 HD13 ' CZ2' ' A' ' 62' ' ' TRP . 56.8 mt -64.08 -41.16 97.41 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.123 -0.944 . . . . 321.58999999999997 111.206 178.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.41 -40.15 93.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.992 -0.549 . . . . 491.97000000000003 111.788 -178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.6 t -64.51 -45.95 94.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 116.582 -0.281 . . . . 179.68000000000001 111.51 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.86 -41.15 75.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.958 0.355 . . . . 483.12 111.958 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.403 ' O ' ' HD1' ' A' ' 27' ' ' PHE . 96.7 mt -66.95 -44.8 88.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.404 -0.362 . . . . 120.91 111.933 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.2 tt -63.18 -32.74 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 111.964 0.357 . . . . 324.41000000000003 111.964 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.66 -45.95 92.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.407 -0.36 . . . . 76.379999999999995 111.457 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.18 -41.94 91.73 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.753 -0.737 . . . . 59.560000000000002 112.617 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.403 ' HD1' ' O ' ' A' ' 23' ' ' ILE . 43.8 m-85 -70.27 -28.05 64.91 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.74 0.274 . . . . 169.43000000000001 111.74 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -76.72 -40.99 46.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.436 -0.209 . . . . 145.09 110.436 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -62.85 -44.56 95.81 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.622 -0.51 . . . . 779.76999999999998 109.622 178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.45 -38.64 96.65 Favored Glycine 0 C--N 1.335 0.489 0 CA-C-N 115.464 -0.789 . . . . 72.329999999999998 112.226 178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 tp -64.09 -42.96 96.73 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.736 0.303 . . . . 213.66999999999999 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 63.5 t -61.51 -45.26 99.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 115.983 -0.553 . . . . 275.81999999999999 110.598 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -62.5 -40.59 97.2 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.838 0.351 . . . . 545.0 110.473 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 89.7 t90 -63.13 -43.95 96.94 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.995 -0.548 . . . . 999.99000000000001 110.033 178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 ' HG3' ' A' ' 47' ' ' LYS . 85.8 mt -62.46 -37.93 87.85 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.698 -0.683 . . . . 205.93000000000001 111.214 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.71 -37.74 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.688 0.28 . . . . 557.46000000000004 111.579 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.6 t -87.33 -50.66 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 113.525 0.935 . . . . 284.56999999999999 113.525 -178.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.9 m80 -101.9 -27.56 12.91 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.022 0.749 . . . . 350.44 113.022 -177.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.566 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -72.08 -11.7 75.0 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.07 -0.586 . . . . 199.69999999999999 113.401 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -60.85 -39.92 90.97 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.819 0.303 . . . . 999.99000000000001 111.819 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 76.6 p -97.85 -8.13 28.95 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.246 0.461 . . . . 302.80000000000001 112.246 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.566 HD12 ' HA2' ' A' ' 39' ' ' GLY . 97.2 mt -73.11 150.7 42.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.064 0.459 . . . . 581.97000000000003 111.819 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.1 m -72.72 161.86 30.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.753 -0.658 . . . . 239.06999999999999 110.642 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 86.1 m -59.48 -40.1 85.86 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.109 -0.496 . . . . 192.00999999999999 111.12 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.607 HG13 ' HB2' ' A' ' 114' ' ' TYR . 55.8 t -65.15 -43.46 95.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.286 -0.415 . . . . 278.44999999999999 110.852 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -64.88 -39.96 94.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.269 -0.423 . . . . 316.42000000000002 111.054 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG3' HD22 ' A' ' 35' ' ' LEU . 87.8 tttt -61.32 -47.18 87.13 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.277 -0.419 . . . . 470.35000000000002 110.795 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.41 -38.61 90.46 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.277 -0.419 . . . . 369.77999999999997 111.399 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.92 -38.53 86.07 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.126 -0.488 . . . . 66.790000000000006 111.608 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -60.11 -30.67 69.42 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.171 -0.468 . . . . 238.30000000000001 111.99 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -62.35 -41.2 98.4 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.631 0.253 . . . . 526.92999999999995 110.769 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -66.58 -41.01 89.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.112 0.482 . . . . 162.88 110.122 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.481 HG22 HH21 ' A' ' 56' ' ' ARG . 62.6 t -60.86 -41.31 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 115.418 -0.81 . . . . 139.00999999999999 110.502 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -58.79 -42.15 88.35 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.928 -0.578 . . . . 198.61000000000001 110.506 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.6 mmt85 -63.28 -44.57 94.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.511 -0.313 . . . . 999.99000000000001 110.975 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.481 HH21 HG22 ' A' ' 53' ' ' VAL . 80.7 mtm180 -65.27 -42.41 93.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.989 0.423 . . . . 799.64999999999998 111.168 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -62.05 -44.43 96.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.535 -0.757 . . . . 151.58000000000001 110.499 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 9.0 ttp -59.4 -40.88 88.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.864 -0.607 . . . . 168.43000000000001 110.744 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.19 -42.54 99.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.169 -0.469 . . . . 530.55999999999995 111.365 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 134' ' ' MET . 75.4 p -71.39 -37.87 71.52 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.806 0.336 . . . . 293.49000000000001 111.116 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -63.99 -44.86 91.41 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.034 -0.53 . . . . 383.72000000000003 109.683 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.405 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 38.6 t-105 -61.74 -45.47 93.77 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.367 -0.833 . . . . 497.0 111.918 179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.41 77.99 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.511 0.56 . . . . 177.0 112.511 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -62.13 -41.49 98.3 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.722 0.267 . . . . 478.75999999999999 111.722 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -82.52 -33.73 28.15 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.623 -0.262 . . . . 727.09000000000003 111.527 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.2 ttp -53.17 -43.93 67.46 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.988 -0.551 . . . . 664.46000000000004 112.02 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 98.1 mt -60.87 -41.41 95.9 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.295 -0.411 . . . . 447.74000000000001 111.339 -178.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -69.03 -39.74 79.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.473 -0.331 . . . . 999.99000000000001 111.299 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -62.95 -45.34 99.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.038 -0.528 . . . . 398.94999999999999 111.349 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -62.33 -37.13 84.45 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.235 -0.439 . . . . 366.97000000000003 112.103 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -60.89 -42.89 98.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.631 0.253 . . . . 709.00999999999999 110.931 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -67.41 -42.46 83.23 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.358 -0.383 . . . . 931.13999999999999 111.419 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.93 -47.04 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.307 -0.406 . . . . 175.25999999999999 111.168 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -63.05 -43.95 97.21 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.161 -0.472 . . . . 443.19 111.452 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.47 -40.77 98.0 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.471 -0.331 . . . . 366.44 111.859 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.1 mt -70.26 -41.34 73.62 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.953 0.406 . . . . 386.93000000000001 111.278 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.52 -10.61 71.13 Favored Glycine 0 CA--C 1.52 0.36 0 CA-C-N 116.05 -0.523 . . . . 244.66999999999999 112.779 179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.5 mpt_? -75.22 149.25 38.96 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.672 0.273 . . . . 999.99000000000001 111.347 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 74.9 p -72.24 138.48 81.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.387 -0.37 . . . . 263.29000000000002 110.585 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.0 136.99 23.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.291 1.994 . . . . 173.88999999999999 112.748 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 84' ' ' ASP . 14.7 m -104.37 155.14 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.283 -0.417 . . . . 201.66 111.243 179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 79.6 t -63.58 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.17 -0.468 . . . . 81.090000000000003 111.169 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.63 97.7 Favored Glycine 0 C--N 1.337 0.59 0 C-N-CA 120.745 -0.741 . . . . 106.63 112.608 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.522 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.2 t70 -64.38 -41.14 96.85 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.156 0.503 . . . . 397.23000000000002 109.807 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -63.0 -42.41 99.84 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.316 -0.856 . . . . 176.41 111.324 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 71.6 p -67.74 -36.2 80.13 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.9 -0.32 . . . . 224.31999999999999 110.932 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -62.83 -46.48 87.75 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.003 0.43 . . . . 999.99000000000001 110.01 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.1 mt -65.27 -41.23 94.42 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 115.747 -0.661 . . . . 158.16999999999999 110.792 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.06 -41.07 99.67 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-N 115.97 -0.559 . . . . 65.709999999999994 112.413 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -62.26 -40.13 95.19 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.605 0.24 . . . . 95.379999999999995 110.95 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -66.98 -40.8 87.49 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.063 0.459 . . . . 381.13999999999999 110.467 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 91.5 mt -64.71 -41.5 92.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.562 -0.745 . . . . 182.12 111.031 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.09 -11.77 59.25 Favored Glycine 0 CA--C 1.52 0.384 0 CA-C-N 115.969 -0.559 . . . . 88.799999999999997 113.694 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 79.5 mtp85 -80.19 -10.96 59.78 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.069 0.434 . . . . 999.99000000000001 111.239 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.2 mmt85 -108.42 129.3 55.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.924 0.392 . . . . 999.99000000000001 110.925 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.83 -76.87 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.235 -0.438 . . . . 308.67000000000002 111.093 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.1 t0 55.79 49.01 17.01 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.999 0.428 . . . . 388.05000000000001 111.649 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.6 mtm -86.52 -2.34 58.39 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.244 -0.435 . . . . 360.56999999999999 111.531 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.15 89.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.172 -0.467 . . . . 184.22999999999999 111.919 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -62.89 -39.02 93.2 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.257 -0.429 . . . . 999.99000000000001 111.868 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.485 ' CE2' HD11 ' A' ' 105' ' ' LEU . 86.7 t80 -58.97 -47.19 86.01 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.821 0.343 . . . . 374.13 110.736 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -59.75 -47.68 84.69 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.002 -0.544 . . . . 999.99000000000001 110.733 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.42 -39.21 89.94 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.039 -0.528 . . . . 558.87 110.931 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -40.41 95.17 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.152 -0.476 . . . . 332.85000000000002 111.317 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.485 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.24 -43.02 99.78 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.606 -0.27 . . . . 472.20999999999998 110.692 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.7 -44.39 93.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.226 -0.443 . . . . 821.44000000000005 110.721 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -58.45 -43.26 88.75 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.777 -0.647 . . . . 746.24000000000001 111.769 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -87.91 -5.16 58.7 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.385 -0.371 . . . . 999.99000000000001 111.647 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.16 43.68 26.37 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.935 0.494 . . . . 675.44000000000005 111.187 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 65.1 mtt -106.1 103.75 13.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 999.99000000000001 111.318 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.7 mt -94.59 117.81 66.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.007 -0.542 . . . . 390.38 110.334 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.43 138.68 33.15 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.29 1.993 . . . . 243.11000000000001 112.887 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -86.27 144.27 27.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.935 -0.575 . . . . 618.10000000000002 110.957 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.607 ' HB2' HG13 ' A' ' 45' ' ' VAL . 47.0 t80 -68.95 99.17 1.03 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.728 0.299 . . . . 999.99000000000001 111.214 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.9 mt -98.74 123.34 50.06 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.419 -0.355 . . . . 415.25 110.975 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.81 -34.27 84.43 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.165 2.576 . . . . 529.14999999999998 112.479 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.98 -43.87 94.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.901 -0.59 . . . . 516.88 111.334 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.77 -41.14 90.4 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.474 -0.33 . . . . 914.60000000000002 110.535 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -61.77 -42.1 98.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.958 -0.565 . . . . 675.30999999999995 110.327 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.48 -43.42 98.86 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.003 -0.544 . . . . 900.95000000000005 111.452 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.578 HG23 HG21 ' A' ' 129' ' ' VAL . 34.6 mm -61.91 -46.32 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.76 0.314 . . . . 300.73000000000002 111.001 178.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -62.5 -40.8 97.89 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.098 -0.501 . . . . 595.28999999999996 111.378 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 67.4 ttp85 -64.86 -34.84 79.32 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.188 -0.46 . . . . 999.99000000000001 111.826 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.9 mtp -72.89 134.49 44.83 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.949 0.404 . . . . 385.68000000000001 111.753 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -53.85 145.05 33.57 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.517 -0.765 . . . . 999.99000000000001 111.3 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.57 -38.5 83.88 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.969 2.446 . . . . 149.59999999999999 112.942 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.45 75.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.572 . . . . 147.02000000000001 112.114 178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -90.03 -15.0 32.71 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.205 0.817 . . . . 360.37 113.205 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.578 HG21 HG23 ' A' ' 121' ' ' ILE . 9.0 p -105.03 130.95 22.26 Favored Pre-proline 0 CA--C 1.535 0.374 0 C-N-CA 120.501 -0.479 . . . . 187.93000000000001 111.441 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -61.3 147.24 96.08 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.816 2.344 . . . . 265.38999999999999 112.491 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.2 m -126.3 152.31 33.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.211 -0.45 . . . . 246.78 110.394 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -118.84 127.7 53.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 999.99000000000001 110.992 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -84.49 80.54 9.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.037 -0.529 . . . . 495.41000000000003 110.478 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.605 ' HB2' HG22 ' A' ' 60' ' ' THR . 97.6 mtp . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.1 -0.953 . . . . 761.34000000000003 111.106 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 . . . . . 0 N--CA 1.463 0.214 0 CA-C-O 121.034 0.445 . . . . 999.99000000000001 111.07 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.9 m -92.42 45.28 1.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.125 -0.489 . . . . 999.99000000000001 112.025 -178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.59 ' HD1' HD21 ' A' ' 67' ' ' LEU . 21.3 t90 -62.2 -45.9 91.32 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.099 0.476 . . . . 999.99000000000001 110.461 178.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.9 m170 -84.12 64.53 8.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.098 -0.501 . . . . 999.99000000000001 110.867 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -123.23 -70.04 0.79 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.983 -0.553 . . . . 999.99000000000001 110.02 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.4 t -123.47 123.06 66.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 375.51999999999998 109.83 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -81.07 149.18 65.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 110.411 -0.218 . . . . 999.99000000000001 110.411 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.82 136.04 37.34 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.085 1.857 . . . . 436.63 112.367 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -120.63 -38.81 2.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 999.99000000000001 111.586 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -103.1 2.39 34.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.791 0.293 . . . . 999.99000000000001 111.791 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.1 tp -57.91 124.12 18.14 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.754 0.312 . . . . 781.60000000000002 110.743 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -113.26 120.1 40.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 216.75 110.495 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -62.1 -37.95 87.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 902.89999999999998 111.068 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.24 82.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.191 -0.458 . . . . 121.34999999999999 111.587 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -77.74 -20.39 53.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.363 -0.38 . . . . 265.05000000000001 110.976 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.39 -42.56 99.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 524.44000000000005 111.612 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.8 m -69.02 -32.55 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 120.961 -0.296 . . . . 214.56 111.685 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.57 -44.32 96.63 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.114 0.483 . . . . 61.909999999999997 110.252 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.52 HD11 ' HB3' ' A' ' 85' ' ' TYR . 90.9 mt -69.51 -38.2 77.49 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.475 -0.784 . . . . 321.58999999999997 111.329 178.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -59.03 -41.92 88.93 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.548 -0.751 . . . . 491.97000000000003 111.794 -178.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.01 -44.69 99.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.527 0.204 . . . . 179.68000000000001 111.116 -179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.88 -40.78 91.92 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.82 0.343 . . . . 483.12 111.148 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.72 -42.78 95.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.913 -0.585 . . . . 120.91 111.503 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 86.8 mt -60.21 -42.5 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 116.391 -0.368 . . . . 324.41000000000003 111.621 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.87 94.89 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.079 -0.248 . . . . 76.379999999999995 111.42 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.416 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -66.61 -40.69 94.16 Favored Glycine 0 C--N 1.334 0.462 0 C-N-CA 120.876 -0.678 . . . . 59.560000000000002 112.578 178.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -73.12 -18.34 61.3 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 122.762 0.425 . . . . 169.43000000000001 112.009 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -75.04 -38.96 61.31 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.787 0.291 . . . . 145.09 111.787 -178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 26' ' ' GLY . 16.7 ptm180 -66.19 -32.3 73.65 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 120.516 -0.474 . . . . 779.76999999999998 110.11 179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.96 -39.16 97.72 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 115.683 -0.69 . . . . 72.329999999999998 112.138 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.583 HD11 ' HB2' ' A' ' 54' ' ' ASN . 84.2 mt -63.77 -39.28 93.87 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.55 0.214 . . . . 213.66999999999999 110.876 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.496 ' O ' ' HG3' ' A' ' 36' ' ' ARG . 69.6 t -61.03 -46.73 96.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.16 -0.473 . . . . 275.81999999999999 111.095 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -64.23 -41.5 96.97 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.908 0.385 . . . . 545.0 110.979 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.56 ' O ' HG12 ' A' ' 37' ' ' VAL . 76.5 t90 -65.46 -43.33 90.7 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.404 0.621 . . . . 999.99000000000001 110.39 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.885 HD11 HD22 ' A' ' 42' ' ' LEU . 48.0 tp -61.46 -33.19 73.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.187 -0.915 . . . . 205.93000000000001 112.487 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 32' ' ' VAL . 99.4 mtt180 -58.24 -28.49 64.95 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.38 0.881 . . . . 557.46000000000004 113.38 -178.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 34' ' ' TRP . 8.6 p -84.5 -26.33 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.667 -0.413 . . . . 284.56999999999999 112.022 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.7 m170 -111.2 15.28 21.58 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.65 0.262 . . . . 350.44 111.257 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -39.81 97.81 Favored Glycine 0 CA--C 1.518 0.248 0 CA-C-N 116.066 -0.515 . . . . 199.69999999999999 114.293 -179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.53 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -65.12 -23.23 67.08 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.606 0.595 . . . . 999.99000000000001 112.606 -179.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.53 HG23 ' HG3' ' A' ' 40' ' ' ARG . 44.6 p -112.83 11.65 19.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.046 0.387 . . . . 302.80000000000001 112.046 -179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.885 HD22 HD11 ' A' ' 35' ' ' LEU . 56.6 tp -71.9 122.49 20.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 581.97000000000003 112.041 -179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 71.1 m -80.53 159.21 25.58 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.963 -0.562 . . . . 239.06999999999999 110.033 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.9 m -61.73 -43.77 98.22 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.659 0.266 . . . . 192.00999999999999 111.639 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 t -73.22 -31.22 33.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 111.7 0.259 . . . . 278.44999999999999 111.7 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -62.8 -38.54 91.09 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.784 0.29 . . . . 316.42000000000002 111.784 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -59.77 -46.26 89.74 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.732 0.301 . . . . 470.35000000000002 110.388 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.42 -39.0 91.6 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.221 -0.445 . . . . 369.77999999999997 110.396 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.53 -36.54 80.84 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 115.549 -0.75 . . . . 66.790000000000006 111.849 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.21 -36.68 78.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.372 -0.376 . . . . 238.30000000000001 111.904 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -61.22 -39.61 90.9 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.471 -0.566 . . . . 526.92999999999995 109.471 178.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -66.72 -39.84 88.18 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.757 -0.656 . . . . 162.88 109.776 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 63.2 t -60.11 -39.15 79.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.142 0 CA-C-N 115.741 -0.663 . . . . 139.00999999999999 110.461 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.583 ' HB2' HD11 ' A' ' 31' ' ' LEU . 29.2 t-20 -56.88 -47.05 81.37 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.327 -0.397 . . . . 198.61000000000001 110.799 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.97 -40.56 91.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.664 -0.244 . . . . 999.99000000000001 110.756 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -62.07 -45.49 93.28 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.056 0.455 . . . . 799.64999999999998 110.111 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -60.44 -47.04 87.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.571 -0.74 . . . . 151.58000000000001 110.157 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -46.9 88.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.006 -0.543 . . . . 168.43000000000001 111.474 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.499 ' HG2' HG23 ' A' ' 131' ' ' VAL . 77.5 mt-30 -62.85 -43.44 98.79 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.005 0.372 . . . . 530.55999999999995 112.005 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.3 p -71.57 -40.42 69.95 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.797 0.295 . . . . 293.49000000000001 111.797 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.435 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 61.1 t-80 -64.13 -47.56 79.47 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.875 0.369 . . . . 383.72000000000003 110.548 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -63.74 -44.15 94.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.747 -0.661 . . . . 497.0 112.081 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -40.64 83.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.796 0.665 . . . . 177.0 112.796 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -64.62 -40.89 96.29 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.921 0.341 . . . . 478.75999999999999 111.921 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 79.8 m-85 -81.49 -26.78 34.92 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.757 0.28 . . . . 727.09000000000003 111.757 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 60.5 ttp -52.54 -41.6 63.67 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.051 -0.522 . . . . 664.46000000000004 112.072 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.59 HD21 ' HD1' ' A' ' 3' ' ' TRP . 4.0 mm? -58.78 -44.61 90.7 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.663 -0.244 . . . . 447.74000000000001 111.494 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.6 m0 -67.36 -41.15 85.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 999.99000000000001 110.818 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 47.5 mm -67.37 -45.41 85.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 115.95 -0.568 . . . . 398.94999999999999 111.047 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -61.16 -41.93 97.65 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.949 -0.569 . . . . 366.97000000000003 111.47 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -60.18 -45.55 92.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.435 -0.348 . . . . 709.00999999999999 110.63 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.62 -42.66 95.36 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.402 -0.363 . . . . 931.13999999999999 111.269 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.4 mt -63.8 -46.92 93.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 120.813 0.34 . . . . 175.25999999999999 111.164 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -62.43 -40.81 97.77 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.257 -0.429 . . . . 443.19 111.312 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.46 95.92 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.374 -0.375 . . . . 366.44 111.419 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.1 mt -69.77 -40.47 76.05 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 116.341 -0.39 . . . . 386.93000000000001 111.341 179.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.5 -8.22 79.59 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 121.044 -0.598 . . . . 244.66999999999999 112.507 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -74.76 153.06 38.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 999.99000000000001 111.707 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -108.53 95.96 17.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.008 -0.542 . . . . 263.29000000000002 110.651 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -70.89 147.61 55.96 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.552 2.168 . . . . 173.88999999999999 113.282 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -101.07 -175.37 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.615 -0.721 . . . . 201.66 111.142 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.3 t -58.77 -41.97 84.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.404 -0.362 . . . . 81.090000000000003 110.718 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.615 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.57 -40.62 98.1 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.658 -0.782 . . . . 106.63 112.181 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -66.15 -40.58 90.7 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 397.23000000000002 110.692 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.52 ' HB3' HD11 ' A' ' 19' ' ' LEU . 33.3 m-85 -69.18 -36.26 77.14 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.705 -0.68 . . . . 176.41 112.174 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.615 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.8 OUTLIER -58.52 -31.64 68.1 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 111.638 0.236 . . . . 224.31999999999999 111.638 -179.089 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.21 -46.34 89.35 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.722 -0.473 . . . . 999.99000000000001 109.722 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -67.71 -39.82 84.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.582 -0.735 . . . . 158.16999999999999 110.423 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.03 -40.66 99.2 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 115.717 -0.674 . . . . 65.709999999999994 112.436 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.77 -41.22 97.42 Favored 'General case' 0 C--N 1.335 -0.064 0 CA-C-O 120.745 0.307 . . . . 95.379999999999995 110.498 179.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -62.48 -40.06 95.46 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 116.039 -0.528 . . . . 381.13999999999999 110.596 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 37.4 mm -63.28 -43.65 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 115.948 -0.569 . . . . 182.12 110.383 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 -20.61 66.84 Favored Glycine 0 CA--C 1.521 0.457 0 CA-C-N 115.873 -0.603 . . . . 88.799999999999997 113.609 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 42.0 mmt180 -79.73 -16.12 56.22 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.939 0.369 . . . . 999.99000000000001 111.384 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.6 mmm180 -107.7 111.72 24.06 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.015 -0.365 . . . . 999.99000000000001 110.015 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -125.44 125.33 68.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.412 -0.358 . . . . 308.67000000000002 110.164 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.6 70.3 1.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.986 0.422 . . . . 388.05000000000001 110.888 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.82 -29.01 66.18 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.885 -0.598 . . . . 360.56999999999999 110.764 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.03 79.88 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.532 -0.758 . . . . 184.22999999999999 111.405 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -58.44 -46.98 85.45 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.113 -0.494 . . . . 999.99000000000001 111.064 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.27 -48.17 81.29 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.781 0.324 . . . . 374.13 110.728 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.69 -47.96 83.92 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.987 -0.551 . . . . 999.99000000000001 110.995 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -62.2 -39.08 91.55 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.055 -0.52 . . . . 558.87 111.609 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.44 -40.47 94.57 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.384 -0.371 . . . . 332.85000000000002 111.265 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 90.2 mt -63.33 -40.83 98.37 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.304 -0.407 . . . . 472.20999999999998 110.667 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -64.7 -40.18 94.93 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.008 -0.542 . . . . 821.44000000000005 110.903 179.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.32 -43.36 88.16 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.882 -0.599 . . . . 746.24000000000001 111.525 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt -87.19 -6.92 58.43 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.241 -0.436 . . . . 999.99000000000001 111.472 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 56.42 37.24 28.65 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.956 0.502 . . . . 675.44000000000005 111.334 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 67.8 ttp -116.89 117.37 29.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 999.99000000000001 111.311 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.75 119.54 65.96 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.051 -0.522 . . . . 390.38 110.224 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -59.07 138.87 87.91 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.515 2.143 . . . . 243.11000000000001 112.33 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.2 mtpt -85.49 119.52 25.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.414 -0.357 . . . . 618.10000000000002 110.966 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -70.01 89.84 0.62 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.068 -0.514 . . . . 999.99000000000001 110.562 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 86.4 mt -97.8 141.93 23.76 Favored Pre-proline 0 C--N 1.328 -0.338 0 N-CA-C 112.006 0.372 . . . . 415.25 112.006 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.4 Cg_exo -58.6 -33.04 97.88 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.237 2.625 . . . . 529.14999999999998 112.575 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 24.5 t80 -59.72 -44.54 93.68 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.077 -0.51 . . . . 516.88 111.203 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 65.6 mtt -60.51 -40.2 90.55 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.798 -0.445 . . . . 914.60000000000002 109.798 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -61.94 -40.57 96.0 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.619 -0.718 . . . . 675.30999999999995 110.444 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.14 -39.79 94.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.694 -0.685 . . . . 900.95000000000005 111.072 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.3 mt -61.09 -43.64 96.67 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.434 -0.348 . . . . 300.73000000000002 110.73 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.77 -37.78 83.02 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.258 -0.428 . . . . 595.28999999999996 110.336 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -64.11 -33.39 75.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.64 . . . . 999.99000000000001 110.758 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 69.6 mtm -68.47 140.0 55.72 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.462 -0.335 . . . . 385.68000000000001 110.956 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.472 ' O ' HG23 ' A' ' 129' ' ' VAL . 55.6 mmm-85 -52.46 137.48 41.09 Favored Pre-proline 0 N--CA 1.465 0.302 0 CA-C-N 115.892 -0.595 . . . . 999.99000000000001 111.51 178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.9 -35.13 79.01 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 123.316 2.677 . . . . 149.59999999999999 113.229 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.67 -36.1 77.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 147.02000000000001 112.106 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.75 -1.98 57.83 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.87 0.322 . . . . 360.37 111.87 -179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 125' ' ' ARG . 68.7 t -98.59 115.75 65.66 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 120.679 0.276 . . . . 187.93000000000001 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -70.57 156.09 61.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.671 2.247 . . . . 265.38999999999999 112.473 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.499 HG23 ' HG2' ' A' ' 59' ' ' GLN . 3.5 p -106.89 139.78 27.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 246.78 110.448 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -107.87 131.88 54.04 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.057 0.456 . . . . 999.99000000000001 110.879 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -83.95 156.71 22.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.848 -0.614 . . . . 495.41000000000003 110.733 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.2 mmm . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.425 -0.798 . . . . 761.34000000000003 111.045 -179.6 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 . . . . . 0 N--CA 1.471 0.613 0 CA-C-O 120.644 0.259 . . . . 999.99000000000001 111.661 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.446 ' HB2' HD21 ' A' ' 67' ' ' LEU . 41.3 m -115.7 89.94 3.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.032 0.444 . . . . 999.99000000000001 110.872 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.7 m-90 -101.97 21.8 14.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.283 -0.417 . . . . 999.99000000000001 110.837 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -89.58 -3.5 58.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 999.99000000000001 111.292 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -107.57 -59.3 1.85 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.985 0.422 . . . . 999.99000000000001 110.269 179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 31.0 m -131.11 152.15 37.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.928 -0.578 . . . . 375.51999999999998 110.234 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.05 149.82 70.61 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 120.881 0.372 . . . . 999.99000000000001 111.376 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.25 161.21 45.15 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.052 2.501 . . . . 436.63 113.076 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.0 mttp 67.42 17.32 10.1 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.428 -0.805 . . . . 999.99000000000001 112.258 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -62.28 -50.09 73.08 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.079 0.466 . . . . 999.99000000000001 110.378 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.06 139.84 56.43 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.411 -0.813 . . . . 781.60000000000002 111.245 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -61.69 129.83 42.95 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.396 -0.365 . . . . 216.75 110.293 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -63.24 -20.34 65.36 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.556 0.576 . . . . 902.89999999999998 112.556 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.3 -39.09 81.91 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.75 0.309 . . . . 121.34999999999999 111.632 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -68.37 -30.45 69.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.194 -0.457 . . . . 265.05000000000001 110.885 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.25 -39.68 94.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.05 -0.523 . . . . 524.44000000000005 110.76 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.6 -48.98 86.26 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 CA-C-N 116.148 -0.478 . . . . 214.56 111.386 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.25 -41.69 99.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.023 -0.535 . . . . 61.909999999999997 111.433 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 85' ' ' TYR . 51.6 tp -66.5 -41.42 88.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 321.58999999999997 111.392 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -59.28 -35.24 73.4 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.952 -0.567 . . . . 491.97000000000003 112.054 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.4 t -62.17 -44.15 98.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.822 0.344 . . . . 179.68000000000001 110.291 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -69.97 -38.57 76.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.961 0.41 . . . . 483.12 110.465 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.8 mt -61.05 -47.09 95.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.765 0.654 . . . . 120.91 112.765 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 32.9 pt -60.26 -36.22 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 N-CA-C 112.775 0.657 . . . . 324.41000000000003 112.775 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.91 -46.22 90.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.665 0.269 . . . . 76.379999999999995 111.361 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.67 -41.14 89.95 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 121.138 -0.554 . . . . 59.560000000000002 112.888 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -73.62 -21.09 60.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.664 -0.268 . . . . 169.43000000000001 111.704 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.447 ' O ' HG23 ' A' ' 32' ' ' VAL . 16.3 t70 -77.12 -40.23 46.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.684 -0.235 . . . . 145.09 110.705 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.07 -42.38 99.65 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.001 0.429 . . . . 779.76999999999998 109.954 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.4 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -65.48 -39.59 95.74 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-N 115.639 -0.709 . . . . 72.329999999999998 111.773 178.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.9 -41.62 98.12 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 115.64 -0.28 . . . . 213.66999999999999 110.768 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 28' ' ' ASP . 64.4 t -60.72 -42.77 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 116.18 -0.464 . . . . 275.81999999999999 111.115 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -61.39 -41.56 97.32 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.608 -0.269 . . . . 545.0 111.21 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.558 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 1.8 m-90 -74.24 -37.3 63.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.036 0.446 . . . . 999.99000000000001 110.94 178.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 61.3 tp -64.31 -41.85 96.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.945 -0.571 . . . . 205.93000000000001 112.039 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -66.18 -23.0 66.38 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.192 0.812 . . . . 557.46000000000004 113.192 -178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 31.1 m -98.21 -20.0 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 N-CA-C 112.991 0.737 . . . . 284.56999999999999 112.991 -179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -109.35 -27.41 9.52 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.879 -0.328 . . . . 350.44 111.666 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.95 -26.33 60.65 Favored Glycine 0 C--N 1.331 0.265 0 CA-C-N 115.801 -0.636 . . . . 199.69999999999999 114.38 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.56 ' HG3' HG23 ' A' ' 41' ' ' THR . 12.3 ptp85 -66.4 -22.49 66.23 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.558 0.679 . . . . 999.99000000000001 111.36 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 40' ' ' ARG . 66.1 p -112.55 -20.67 11.65 Favored 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 112.234 0.457 . . . . 302.80000000000001 112.234 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.1 mt -73.09 147.32 45.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.122 0.487 . . . . 581.97000000000003 112.093 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.2 t -75.97 163.62 26.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.642 -0.708 . . . . 239.06999999999999 109.75 178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.3 m -58.88 -42.31 89.2 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.826 0.346 . . . . 192.00999999999999 110.893 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.55 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.2 t -66.09 -42.23 91.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.311 -0.404 . . . . 278.44999999999999 110.581 179.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.25 -40.21 96.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.147 -0.479 . . . . 316.42000000000002 111.455 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -63.14 -41.99 99.39 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.661 0.267 . . . . 470.35000000000002 110.83 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.37 -39.25 85.65 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.005 0.431 . . . . 369.77999999999997 110.374 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 118' ' ' MET . . . -61.7 -36.16 80.1 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.556 -0.747 . . . . 66.790000000000006 111.105 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.3 tp -58.78 -38.91 79.57 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.751 -0.659 . . . . 238.30000000000001 111.193 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -60.7 -40.52 92.52 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.836 0.35 . . . . 526.92999999999995 110.343 179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -65.85 -40.65 91.91 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.92 -0.582 . . . . 162.88 109.968 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.82 -41.13 87.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 115.5 -0.773 . . . . 139.00999999999999 110.872 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -59.13 -42.73 91.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.312 -0.404 . . . . 198.61000000000001 110.598 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -65.03 -41.81 94.89 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.824 0.345 . . . . 999.99000000000001 110.519 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -63.41 -43.93 96.08 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.914 -0.585 . . . . 799.64999999999998 110.619 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -59.81 -48.34 82.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.704 -0.68 . . . . 151.58000000000001 111.039 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -61.16 -44.22 97.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.423 -0.353 . . . . 168.43000000000001 111.109 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.3 -43.21 99.34 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.113 0.412 . . . . 530.55999999999995 112.113 -179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 42.2 p -71.61 -41.16 69.26 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.959 -0.296 . . . . 293.49000000000001 111.571 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.9 t60 -63.22 -46.77 85.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.179 0.514 . . . . 383.72000000000003 110.179 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -63.83 -38.7 92.09 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 115.291 -0.868 . . . . 497.0 111.826 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.34 -38.79 74.65 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.727 0.269 . . . . 177.0 111.727 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -60.87 -44.08 97.53 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.792 0.33 . . . . 478.75999999999999 110.302 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -70.6 -36.19 73.39 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.129 -0.487 . . . . 727.09000000000003 111.254 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 75.9 mmm -51.7 -35.22 41.93 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.065 -0.516 . . . . 664.46000000000004 112.261 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.446 HD21 ' HB2' ' A' ' 2' ' ' SER . 65.1 tp -59.29 -50.03 75.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.613 0.244 . . . . 447.74000000000001 111.168 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -69.45 -40.1 77.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.354 -0.385 . . . . 999.99000000000001 111.394 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.7 mm -64.78 -46.05 93.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 115.987 -0.551 . . . . 398.94999999999999 111.51 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.51 -43.09 99.67 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.368 -0.378 . . . . 366.97000000000003 111.23 -179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.59 -41.94 98.3 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.522 -0.308 . . . . 709.00999999999999 110.933 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -62.73 -47.1 85.02 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 931.13999999999999 110.83 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.1 mt -63.69 -45.92 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.131 -0.486 . . . . 175.25999999999999 110.942 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -62.45 -45.1 94.58 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.227 -0.442 . . . . 443.19 111.684 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.25 -40.66 98.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.654 -0.248 . . . . 366.44 111.594 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.4 tp -68.13 -45.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.152 0.501 . . . . 386.93000000000001 110.592 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.03 -23.02 31.27 Favored Glycine 0 C--N 1.331 0.278 0 CA-C-N 115.708 -0.678 . . . . 244.66999999999999 112.789 179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -76.54 141.79 41.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.602 0.239 . . . . 999.99000000000001 110.932 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 40.3 p -82.0 134.41 49.71 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.579 -0.282 . . . . 263.29000000000002 110.702 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 154.95 46.48 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.66 2.24 . . . . 173.88999999999999 112.745 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.544 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.3 m -101.72 158.04 4.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.346 -0.388 . . . . 201.66 110.1 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.09 -45.0 96.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.391 -0.368 . . . . 81.090000000000003 111.97 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.459 ' O ' HG22 ' A' ' 86' ' ' THR . . . -61.26 -44.42 98.11 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.633 -0.794 . . . . 106.63 113.553 -179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.544 ' H ' HG23 ' A' ' 81' ' ' VAL . 33.5 t70 -71.22 -41.62 69.95 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.956 0.378 . . . . 397.23000000000002 111.491 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 19' ' ' LEU . 40.1 t80 -65.23 -39.68 93.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.094 -0.503 . . . . 176.41 111.582 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.459 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -60.46 -24.11 64.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.461 -0.336 . . . . 224.31999999999999 111.891 -179.604 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -62.41 -37.16 84.72 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.79 0.329 . . . . 999.99000000000001 110.887 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.67 -38.96 89.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.909 -0.587 . . . . 158.16999999999999 111.17 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.18 -39.3 96.97 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.916 -0.583 . . . . 65.709999999999994 113.101 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.09 98.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.633 0.254 . . . . 95.379999999999995 111.078 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -63.79 -40.09 95.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.116 -0.493 . . . . 381.13999999999999 110.85 179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 43.5 mm -65.13 -42.71 95.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.772 -0.649 . . . . 182.12 110.953 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.54 -20.16 65.52 Favored Glycine 0 CA--C 1.52 0.388 0 CA-C-N 116.015 -0.539 . . . . 88.799999999999997 113.603 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -78.65 -24.52 45.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.037 0.418 . . . . 999.99000000000001 111.849 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -108.85 112.15 24.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.818 0.342 . . . . 999.99000000000001 111.352 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.5 pt -134.69 153.47 35.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.325 -0.398 . . . . 308.67000000000002 110.757 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -147.17 55.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.053 0.454 . . . . 388.05000000000001 110.608 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 79.0 mtm -69.32 -28.81 66.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.78 -0.646 . . . . 360.56999999999999 111.711 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.558 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -60.14 -40.16 88.84 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.286 -0.415 . . . . 184.22999999999999 111.717 -179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -64.15 -41.55 97.14 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.554 -0.293 . . . . 999.99000000000001 111.126 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -64.11 -43.89 93.94 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.697 -0.483 . . . . 374.13 109.697 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -60.11 -47.45 85.86 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.555 -0.748 . . . . 999.99000000000001 110.413 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -61.39 -40.51 94.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 558.87 110.694 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.04 96.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.094 -0.503 . . . . 332.85000000000002 111.37 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 89.0 mt -62.92 -42.94 99.96 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.655 -0.248 . . . . 472.20999999999998 110.587 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -64.36 -42.99 95.92 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.029 -0.532 . . . . 821.44000000000005 110.932 179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -57.97 -43.45 86.48 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.843 -0.617 . . . . 746.24000000000001 111.912 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -89.38 -4.91 57.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.547 -0.297 . . . . 999.99000000000001 111.47 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.5 t30 56.74 41.11 28.66 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.11 0.564 . . . . 675.44000000000005 111.226 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.3 mmm -108.04 101.76 10.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 999.99000000000001 111.342 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 76.1 mt -94.48 118.38 66.96 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.134 -0.485 . . . . 390.38 110.119 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -58.65 135.75 69.43 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.529 2.152 . . . . 243.11000000000001 112.754 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.49 143.37 28.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.202 -0.454 . . . . 618.10000000000002 110.673 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.55 ' HB2' HG13 ' A' ' 45' ' ' VAL . 27.8 t80 -68.86 108.05 3.31 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.903 0.382 . . . . 999.99000000000001 110.638 179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.69 146.51 31.74 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.176 -0.465 . . . . 415.25 111.133 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -57.15 -38.38 95.61 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.886 2.391 . . . . 529.14999999999998 112.082 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -62.17 -39.43 92.67 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.64 -0.709 . . . . 516.88 110.871 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttm -58.34 -46.38 86.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.103 -0.499 . . . . 914.60000000000002 110.236 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.12 -43.67 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.213 -0.448 . . . . 675.30999999999995 110.431 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 124' ' ' MET . 96.6 mt-10 -65.14 -42.08 94.16 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.111 0.782 . . . . 900.95000000000005 113.111 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.484 HG22 ' O ' ' A' ' 118' ' ' MET . 15.3 tt -64.64 -28.68 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 111.816 0.302 . . . . 300.73000000000002 111.816 -179.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -63.48 -35.82 81.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.875 0.369 . . . . 595.28999999999996 111.005 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.54 -1.67 57.82 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.862 -0.608 . . . . 999.99000000000001 112.239 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 66.1 mtt -88.18 128.88 35.45 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.719 0.295 . . . . 385.68000000000001 111.573 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.529 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.5 mmt180 -53.51 142.52 40.57 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 115.939 -0.573 . . . . 999.99000000000001 110.758 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -52.46 -36.93 71.85 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.101 2.534 . . . . 149.59999999999999 113.283 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.17 -35.65 77.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 147.02000000000001 111.926 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -91.64 1.22 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.493 0.553 . . . . 360.37 112.493 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.4 t -90.34 113.02 55.97 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.789 0.328 . . . . 187.93000000000001 110.965 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -75.67 157.25 40.04 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.812 2.341 . . . . 265.38999999999999 112.761 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 34.7 m -123.75 157.55 30.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.361 -0.381 . . . . 246.78 110.398 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -132.08 145.86 51.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.059 0.457 . . . . 999.99000000000001 111.326 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -84.89 168.05 15.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 495.41000000000003 111.031 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.167 -0.92 . . . . 761.34000000000003 110.949 179.945 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 . . . . . 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 999.99000000000001 110.19 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 m -87.31 -11.06 50.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.512 -0.313 . . . . 999.99000000000001 111.807 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.86 102.08 7.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.64 0.257 . . . . 999.99000000000001 110.871 -179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.06 2.07 40.04 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.889 0.329 . . . . 999.99000000000001 111.889 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -126.07 -68.35 0.83 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.769 0.318 . . . . 999.99000000000001 111.813 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.5 m -130.05 154.92 41.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.376 -0.374 . . . . 375.51999999999998 110.897 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -80.4 147.32 63.77 Favored Pre-proline 0 C--O 1.234 0.277 0 CA-C-N 116.39 -0.368 . . . . 999.99000000000001 110.55 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.82 148.35 40.91 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.763 2.308 . . . . 436.63 113.299 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 tptt -73.76 135.32 43.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.808 -0.633 . . . . 999.99000000000001 109.652 178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -77.85 93.29 4.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.981 0.419 . . . . 999.99000000000001 110.793 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.68 142.41 45.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.522 -0.763 . . . . 781.60000000000002 111.831 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.427 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 64.6 t30 -66.47 132.58 48.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.784 -0.45 . . . . 216.75 109.784 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.07 -40.52 93.99 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.657 -0.247 . . . . 902.89999999999998 111.655 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.426 ' O ' HG22 ' A' ' 17' ' ' VAL . . . -60.29 -39.82 88.28 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 121.34999999999999 111.521 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -73.21 -28.37 62.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.208 -0.451 . . . . 265.05000000000001 111.004 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 12' ' ' ASN . 96.4 mt-10 -63.88 -39.96 95.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 112.296 0.48 . . . . 524.44000000000005 112.296 -178.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.426 HG22 ' O ' ' A' ' 14' ' ' ALA . 34.6 m -69.57 -34.1 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 C-N-CA 120.674 -0.41 . . . . 214.56 111.491 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.72 -43.94 95.05 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.248 0.547 . . . . 61.909999999999997 110.277 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.413 HD11 ' HA3' ' A' ' 89' ' ' GLY . 59.0 tp -69.34 -40.53 77.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.15 -0.932 . . . . 321.58999999999997 111.677 179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 24' ' ' ILE . 65.0 tttm -59.74 -39.48 84.91 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.846 -0.616 . . . . 491.97000000000003 112.309 -178.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.54 -43.7 98.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-O 120.396 0.141 . . . . 179.68000000000001 111.019 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.89 -41.53 97.69 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 120.721 0.296 . . . . 483.12 110.855 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.468 HG21 ' SD ' ' A' ' 58' ' ' MET . 97.1 mt -63.3 -44.55 99.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-N 116.063 -0.517 . . . . 120.91 110.873 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 20' ' ' LYS . 36.2 mm -60.68 -43.04 94.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 324.41000000000003 111.37 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.49 -42.84 97.14 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.8 -0.182 . . . . 76.379999999999995 111.397 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.97 -41.85 98.49 Favored Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.88 -0.676 . . . . 59.560000000000002 112.761 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -73.6 -23.8 59.97 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.885 0.328 . . . . 169.43000000000001 111.885 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -78.54 -30.17 46.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.464 -0.335 . . . . 145.09 111.427 -178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -62.79 -42.25 99.62 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.85 0.357 . . . . 779.76999999999998 110.83 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -80.96 -26.76 52.45 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.673 -0.775 . . . . 72.329999999999998 112.457 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 58.9 tp -65.55 -43.09 90.99 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.486 0.184 . . . . 213.66999999999999 111.393 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 29.8 m -66.36 -33.71 65.31 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.128 0 C-N-CA 121.015 -0.274 . . . . 275.81999999999999 111.336 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.62 -40.61 95.79 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-O 121.334 0.588 . . . . 545.0 109.701 178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 80.4 t90 -64.91 -41.75 95.32 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.168 -0.923 . . . . 999.99000000000001 109.588 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 88.5 mt -61.86 -37.04 83.01 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.228 -0.896 . . . . 205.93000000000001 111.146 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtp85 -62.43 -37.13 84.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.615 0.245 . . . . 557.46000000000004 111.42 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.86 -50.06 14.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 113.424 0.898 . . . . 284.56999999999999 113.424 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -107.51 -29.74 9.03 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -69.19 -13.01 66.65 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.093 -0.575 . . . . 199.69999999999999 113.82 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.437 ' HG3' HG23 ' A' ' 41' ' ' THR . 40.8 ptt180 -64.09 -22.04 66.77 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.87 0.335 . . . . 999.99000000000001 111.708 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.437 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.0 p -105.88 -15.35 14.95 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.953 0.406 . . . . 302.80000000000001 111.525 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -73.63 148.76 42.54 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 581.97000000000003 111.546 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -76.97 167.21 22.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.995 -0.548 . . . . 239.06999999999999 110.57 179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 p -64.7 -32.07 73.58 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.987 0.366 . . . . 192.00999999999999 111.987 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.427 HG12 ' HB3' ' A' ' 114' ' ' TYR . 0.4 OUTLIER -69.03 -39.77 80.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.958 0.408 . . . . 278.44999999999999 110.198 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.545 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 90.1 mt-30 -64.99 -41.32 95.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.829 -0.623 . . . . 316.42000000000002 110.879 179.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -63.27 -45.33 92.0 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.078 -0.51 . . . . 470.35000000000002 110.785 179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -64.27 -38.45 91.08 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.716 -0.675 . . . . 369.77999999999997 110.823 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.2 -38.02 85.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.887 -0.597 . . . . 66.790000000000006 111.528 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.411 ' HA ' HG22 ' A' ' 53' ' ' VAL . 88.2 mt -62.24 -38.18 88.25 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.414 -0.357 . . . . 238.30000000000001 111.558 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -63.05 -39.01 93.45 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.306 -0.627 . . . . 526.92999999999995 109.306 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -62.12 -48.06 81.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.344 -0.844 . . . . 162.88 111.608 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.425 HG21 ' CE2' ' A' ' 101' ' ' PHE . 17.2 m -68.89 -24.16 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 C-N-CA 121.016 -0.273 . . . . 139.00999999999999 111.679 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.88 -41.37 91.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.53 -0.304 . . . . 198.61000000000001 110.569 179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.0 mtt85 -62.96 -41.92 99.67 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.491 -0.322 . . . . 999.99000000000001 110.448 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -63.93 -44.03 94.1 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.166 0.507 . . . . 799.64999999999998 110.036 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -60.13 -47.47 85.79 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.226 -0.897 . . . . 151.58000000000001 111.113 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.468 ' SD ' HG21 ' A' ' 23' ' ' ILE . 47.0 ttp -59.33 -45.46 91.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.995 -0.548 . . . . 168.43000000000001 111.068 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.658 ' HG2' HG13 ' A' ' 131' ' ' VAL . 56.5 mt-30 -64.7 -41.47 95.99 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.476 -0.329 . . . . 530.55999999999995 111.139 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -66.09 -45.5 80.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.22 -0.446 . . . . 293.49000000000001 110.787 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -64.38 -42.36 96.19 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.036 -0.529 . . . . 383.72000000000003 110.548 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.43 ' HB2' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -60.11 -41.38 92.44 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.607 -0.724 . . . . 497.0 111.827 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.07 91.26 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.378 0.51 . . . . 177.0 112.378 -178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -62.55 -47.84 82.12 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.984 0.421 . . . . 478.75999999999999 111.014 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.418 ' HE2' HD22 ' A' ' 88' ' ' LEU . 55.7 t80 -68.46 -44.35 75.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.916 -0.584 . . . . 727.09000000000003 111.188 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 62' ' ' TRP . 0.0 OUTLIER -52.18 -39.11 59.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.566 -0.743 . . . . 664.46000000000004 112.893 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 86.2 mt -60.39 -41.62 94.19 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 111.885 0.328 . . . . 447.74000000000001 111.885 -178.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -68.09 -40.47 82.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.977 0.418 . . . . 999.99000000000001 110.69 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.429 ' O ' HG12 ' A' ' 73' ' ' ILE . 48.7 mm -70.62 -41.25 77.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.709 -0.678 . . . . 398.94999999999999 111.293 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -58.94 -40.95 86.2 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.033 -0.53 . . . . 366.97000000000003 111.694 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.91 -43.5 98.71 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.859 0.361 . . . . 709.00999999999999 110.541 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -66.58 -44.92 80.92 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.817 -0.629 . . . . 931.13999999999999 110.938 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 43.2 mm -64.38 -45.01 97.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-N 115.831 -0.622 . . . . 175.25999999999999 111.452 -179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -61.02 -43.79 98.36 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.309 -0.405 . . . . 443.19 111.239 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.21 -40.35 97.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.392 -0.367 . . . . 366.44 111.445 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -70.28 -40.54 74.27 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.422 -0.354 . . . . 386.93000000000001 111.486 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.63 -8.0 80.71 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.962 -0.637 . . . . 244.66999999999999 112.688 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -74.64 148.82 40.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.841 0.353 . . . . 999.99000000000001 111.588 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.6 p -103.77 106.24 51.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 263.29000000000002 110.94 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 33.0 Cg_exo -60.91 143.88 99.45 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.138 2.559 . . . . 173.88999999999999 113.348 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.3 m -100.49 -175.78 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 201.66 110.996 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.39 -42.9 89.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-N 116.414 -0.357 . . . . 81.090000000000003 110.856 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.536 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -40.43 98.18 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 120.825 -0.702 . . . . 106.63 112.506 179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -64.19 -42.26 96.75 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.851 0.357 . . . . 397.23000000000002 110.835 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.45 ' CE1' ' HB2' ' A' ' 80' ' ' PRO . 48.2 m-85 -71.16 -35.8 71.78 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.061 -0.518 . . . . 176.41 111.644 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.536 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.6 OUTLIER -62.43 -35.93 80.8 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.575 0.226 . . . . 224.31999999999999 110.779 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -63.56 -45.03 92.36 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.248 0.547 . . . . 999.99000000000001 109.98 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.418 HD22 ' HE2' ' A' ' 65' ' ' TYR . 98.0 mt -65.82 -40.66 92.03 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 115.47 -0.786 . . . . 158.16999999999999 110.483 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.413 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.87 -39.48 98.07 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 115.687 -0.688 . . . . 65.709999999999994 112.779 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.7 90.07 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.631 0.253 . . . . 95.379999999999995 111.198 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.83 -41.84 97.76 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.27 -0.423 . . . . 381.13999999999999 110.421 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.89 -42.26 91.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.744 -0.662 . . . . 182.12 111.171 179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.49 -9.16 64.3 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.928 -0.578 . . . . 88.799999999999997 113.691 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -77.31 -30.4 54.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.906 0.384 . . . . 999.99000000000001 110.86 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -100.89 120.63 40.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.419 -0.355 . . . . 999.99000000000001 110.421 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 80.9 mt -116.48 119.72 62.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.528 -0.306 . . . . 308.67000000000002 110.773 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -110.97 24.66 12.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.299 -0.409 . . . . 388.05000000000001 111.946 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.7 mmm -61.71 -39.1 90.32 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.602 0.239 . . . . 360.56999999999999 111.28 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.44 -39.25 90.13 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.035 0.445 . . . . 184.22999999999999 110.798 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -66.05 -35.98 82.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.668 -0.696 . . . . 999.99000000000001 111.026 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.425 ' CE2' HG21 ' A' ' 53' ' ' VAL . 87.5 t80 -58.9 -48.95 79.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.329 -0.396 . . . . 374.13 110.514 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -61.01 -47.8 84.74 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.922 -0.581 . . . . 999.99000000000001 110.798 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.56 -39.62 91.77 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.8 -0.636 . . . . 558.87 111.776 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.26 98.49 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.551 -0.295 . . . . 332.85000000000002 111.393 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 91.0 mt -64.79 -40.81 95.85 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.384 -0.371 . . . . 472.20999999999998 110.722 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -63.43 -43.68 96.75 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.892 -0.595 . . . . 821.44000000000005 111.096 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.85 -40.12 83.31 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.122 -0.49 . . . . 746.24000000000001 112.023 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -89.01 -7.24 56.34 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.587 -0.279 . . . . 999.99000000000001 111.287 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 52.9 t30 58.43 32.41 22.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.826 -0.625 . . . . 675.44000000000005 111.258 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 22.4 mmt -107.31 98.5 8.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 999.99000000000001 111.063 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.0 mt -94.24 119.67 66.3 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.022 -0.535 . . . . 390.38 110.514 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.36 150.85 65.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.454 2.102 . . . . 243.11000000000001 112.163 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -84.8 118.31 24.39 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.842 0.353 . . . . 618.10000000000002 110.56 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.545 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 23.7 m-85 -70.33 107.71 3.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.84 -0.618 . . . . 999.99000000000001 111.043 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.7 mt -97.72 143.5 26.33 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.605 -0.271 . . . . 415.25 111.264 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -58.25 -35.07 99.07 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.071 2.514 . . . . 529.14999999999998 112.933 179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -63.02 -34.18 77.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.25 -0.432 . . . . 516.88 111.027 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 95.8 mtp -60.17 -40.07 88.64 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.884 0.373 . . . . 914.60000000000002 110.129 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -62.03 -39.9 93.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.755 -0.657 . . . . 675.30999999999995 110.183 178.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' A' ' 124' ' ' MET . 88.5 tt0 -62.92 -41.68 99.55 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.608 -0.723 . . . . 900.95000000000005 111.146 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 96.5 mt -60.56 -42.37 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.813 0.34 . . . . 300.73000000000002 110.724 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.87 -38.57 82.54 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.08 -0.509 . . . . 595.28999999999996 111.129 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -77.71 -9.66 59.11 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.336 0.495 . . . . 999.99000000000001 112.336 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 68.1 mtt -71.54 139.22 49.39 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.653 0.264 . . . . 385.68000000000001 111.107 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -52.33 136.13 41.14 Favored Pre-proline 0 N--CA 1.465 0.275 0 CA-C-N 115.904 -0.589 . . . . 999.99000000000001 111.263 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -54.31 -36.88 88.13 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 123.039 2.493 . . . . 149.59999999999999 113.079 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.411 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -64.3 -25.48 68.07 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.3 -0.409 . . . . 147.02000000000001 111.851 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -92.03 -1.77 57.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.455 -0.339 . . . . 360.37 111.383 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 60.1 t -99.94 112.98 64.93 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.669 -0.241 . . . . 187.93000000000001 110.745 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.23 152.58 61.73 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.501 2.134 . . . . 265.38999999999999 112.347 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.658 HG13 ' HG2' ' A' ' 59' ' ' GLN . 96.7 t -124.38 135.8 62.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.331 -0.395 . . . . 246.78 110.275 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -133.28 134.71 44.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.385 -0.371 . . . . 999.99000000000001 110.419 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -84.74 92.46 8.22 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.981 0.42 . . . . 495.41000000000003 110.371 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.282 -0.866 . . . . 761.34000000000003 111.345 -179.706 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.1 mtt85 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 120.773 0.32 . . . . 999.99000000000001 110.501 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.0 m -114.5 115.54 27.4 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.899 -0.408 . . . . 999.99000000000001 109.899 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 37.0 p90 -93.84 -5.12 48.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.461 -0.336 . . . . 999.99000000000001 111.836 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -90.84 113.12 25.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.725 0.298 . . . . 999.99000000000001 110.776 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -68.39 -39.77 81.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.107 -0.497 . . . . 999.99000000000001 110.607 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.478 ' HB ' ' OD1' ' A' ' 70' ' ' ASN . 73.1 t -124.15 128.51 74.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 375.51999999999998 109.852 179.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -81.36 125.15 79.67 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.597 -0.274 . . . . 999.99000000000001 110.826 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.72 151.73 63.81 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.698 2.265 . . . . 436.63 112.788 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -132.76 134.89 45.31 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.103 -0.499 . . . . 999.99000000000001 109.722 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 63.81 33.67 12.55 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.582 0.551 . . . . 999.99000000000001 111.49 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -56.26 120.45 7.61 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.257 -0.429 . . . . 781.60000000000002 110.953 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -91.48 106.49 18.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.43 -0.35 . . . . 216.75 111.055 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -65.32 -22.11 66.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.93 -0.577 . . . . 902.89999999999998 111.819 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.65 -38.44 81.43 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.804 0.335 . . . . 121.34999999999999 111.488 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -63.4 -37.29 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.112 -0.494 . . . . 265.05000000000001 109.98 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.76 -39.37 93.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.745 -0.661 . . . . 524.44000000000005 110.419 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 56.0 t -61.59 -46.92 95.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.812 -0.631 . . . . 214.56 111.285 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.01 99.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.22 -0.445 . . . . 61.909999999999997 111.256 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.723 HD11 ' HB3' ' A' ' 85' ' ' TYR . 91.0 mt -67.21 -37.98 84.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.838 -0.619 . . . . 321.58999999999997 111.306 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.15 -39.7 83.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.736 -0.665 . . . . 491.97000000000003 111.586 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 74.1 t -62.82 -44.26 99.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.606 0.241 . . . . 179.68000000000001 110.657 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -65.82 -40.22 91.63 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.939 0.4 . . . . 483.12 110.744 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.07 -41.98 94.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.748 -0.66 . . . . 120.91 111.317 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.5 mt -60.05 -43.15 92.05 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.49 -0.323 . . . . 324.41000000000003 111.193 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -43.98 97.36 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.598 0.237 . . . . 76.379999999999995 111.228 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.48 -40.18 96.08 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.068 -0.587 . . . . 59.560000000000002 112.495 178.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -72.78 -20.49 61.16 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 122.384 0.273 . . . . 169.43000000000001 111.489 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -75.37 -36.42 60.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.535 -0.302 . . . . 145.09 110.557 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -60.84 -44.12 97.4 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.329 -0.619 . . . . 779.76999999999998 109.329 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.63 -39.07 97.43 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.475 -0.784 . . . . 72.329999999999998 112.215 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 83.2 mt -62.14 -40.51 96.19 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.458 0.171 . . . . 213.66999999999999 111.058 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 68.4 t -60.96 -43.97 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.191 -0.459 . . . . 275.81999999999999 110.702 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -60.72 -44.6 96.42 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.147 -0.479 . . . . 545.0 111.02 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -68.03 -38.42 82.51 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.925 0.393 . . . . 999.99000000000001 110.179 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 84.6 mt -62.17 -37.0 83.56 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.929 -0.578 . . . . 205.93000000000001 111.611 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -61.87 -37.12 83.36 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.601 0.238 . . . . 557.46000000000004 111.543 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.5 t -87.82 -52.5 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 N-CA-C 113.502 0.926 . . . . 284.56999999999999 113.502 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -115.36 -5.74 12.32 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.244 0.831 . . . . 350.44 113.244 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.94 -37.86 93.27 Favored Glycine 0 N--CA 1.46 0.282 0 C-N-CA 121.29 -0.481 . . . . 199.69999999999999 113.685 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.405 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.8 ptm180 -62.01 -18.66 61.26 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.265 0.468 . . . . 999.99000000000001 112.265 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.405 HG23 ' HG3' ' A' ' 40' ' ' ARG . 73.5 p -106.15 1.07 25.9 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.409 0.522 . . . . 302.80000000000001 112.409 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.424 HD12 ' HA2' ' A' ' 39' ' ' GLY . 86.8 mt -72.27 141.22 48.91 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.0 0.429 . . . . 581.97000000000003 111.962 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.0 m -77.78 162.77 26.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.746 -0.661 . . . . 239.06999999999999 110.495 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.9 m -60.02 -42.39 94.23 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.818 0.342 . . . . 192.00999999999999 110.96 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.617 HG13 ' HB2' ' A' ' 114' ' ' TYR . 63.7 t -65.89 -41.96 91.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.125 -0.488 . . . . 278.44999999999999 110.799 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.15 -40.91 98.94 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.21 -0.45 . . . . 316.42000000000002 111.178 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 50' ' ' LEU . 64.2 tttm -61.47 -45.7 93.13 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.386 -0.37 . . . . 470.35000000000002 110.924 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.03 -38.72 91.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.287 -0.415 . . . . 369.77999999999997 111.019 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.21 -22.94 66.34 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.729 -0.668 . . . . 66.790000000000006 112.433 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.493 ' HA ' HD13 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -53.85 -36.27 62.4 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.384 0.512 . . . . 238.30000000000001 112.384 -179.303 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -62.41 -41.21 98.51 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.796 0.331 . . . . 526.92999999999995 110.785 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -70.43 -37.61 74.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 162.88 110.22 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.34 -41.22 86.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.669 -0.696 . . . . 139.00999999999999 111.014 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.44 HD21 HD11 ' A' ' 31' ' ' LEU . 38.8 m-80 -59.99 -39.79 86.96 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.778 -0.192 . . . . 198.61000000000001 110.943 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -61.62 -46.15 91.04 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.789 0.328 . . . . 999.99000000000001 110.235 178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -63.28 -41.72 99.03 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.979 -0.555 . . . . 799.64999999999998 110.61 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -61.77 -41.52 97.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.568 -0.742 . . . . 151.58000000000001 110.036 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 98.2 mtp -64.97 -38.55 91.32 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.961 -0.563 . . . . 168.43000000000001 111.364 178.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.03 -40.9 95.36 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.833 0.679 . . . . 530.55999999999995 112.833 -178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.471 ' HA ' ' SD ' ' A' ' 134' ' ' MET . 75.8 p -68.46 -38.85 81.48 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.694 -0.402 . . . . 293.49000000000001 111.371 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.474 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 69.9 m80 -70.7 -40.13 73.06 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.351 -0.386 . . . . 383.72000000000003 111.206 179.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.423 ' HH2' HD13 ' A' ' 19' ' ' LEU . 30.7 m95 -63.85 -39.84 95.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.112 -0.494 . . . . 497.0 112.206 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.73 90.65 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.828 0.307 . . . . 177.0 111.828 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -65.04 -46.86 79.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.828 0.347 . . . . 478.75999999999999 111.486 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.492 ' O ' HG12 ' A' ' 69' ' ' ILE . 62.7 m-85 -70.54 -40.52 73.35 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.346 -0.388 . . . . 727.09000000000003 112.025 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 17.7 tpt -53.76 -50.13 66.71 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.184 0.438 . . . . 664.46000000000004 112.184 -179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.95 -39.96 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.957 0.354 . . . . 447.74000000000001 111.957 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -61.99 -47.88 82.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 999.99000000000001 111.67 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.7 pt -80.11 -24.63 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.43 0.53 . . . . 398.94999999999999 112.43 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.478 ' OD1' ' HB ' ' A' ' 6' ' ' VAL . 28.6 t-20 -58.73 -45.52 89.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.613 0.227 . . . . 366.97000000000003 111.613 -178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.23 -41.73 96.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.548 -0.296 . . . . 709.00999999999999 111.237 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -70.06 -42.7 72.51 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.135 0.42 . . . . 931.13999999999999 112.135 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.4 mt -62.83 -46.62 95.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 120.578 0.228 . . . . 175.25999999999999 111.433 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.58 -46.89 86.26 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.465 -0.334 . . . . 443.19 111.757 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.51 -41.16 96.59 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.171 0.434 . . . . 366.44 112.171 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.1 mt -71.13 -40.6 71.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.875 0.369 . . . . 386.93000000000001 111.594 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.1 -8.23 78.93 Favored Glycine 0 CA--C 1.52 0.36 0 C-N-CA 121.042 -0.599 . . . . 244.66999999999999 112.287 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.8 mmt-85 -75.22 150.65 38.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.944 0.402 . . . . 999.99000000000001 111.546 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.8 p -107.42 100.98 36.86 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 263.29000000000002 110.634 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.516 ' HB2' ' CE1' ' A' ' 85' ' ' TYR . 46.0 Cg_exo -59.51 140.98 96.58 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.022 2.481 . . . . 173.88999999999999 113.398 -179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.29 -175.69 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.766 -0.652 . . . . 201.66 111.115 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.6 t -59.31 -41.6 84.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 116.375 -0.375 . . . . 81.090000000000003 110.909 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.577 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.38 -40.68 97.88 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.815 -0.707 . . . . 106.63 112.536 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -70.1 -42.29 72.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.018 0.437 . . . . 397.23000000000002 110.803 178.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.723 ' HB3' HD11 ' A' ' 19' ' ' LEU . 26.5 m-85 -68.0 -34.13 75.94 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.809 -0.632 . . . . 176.41 112.687 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.577 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.2 t -56.03 -32.57 64.13 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 111.686 0.254 . . . . 224.31999999999999 111.686 -179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -62.48 -45.42 93.11 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.05 0.453 . . . . 999.99000000000001 109.982 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.3 mt -66.12 -40.78 90.94 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.695 -0.684 . . . . 158.16999999999999 110.559 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.53 -40.64 99.37 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.661 -0.699 . . . . 65.709999999999994 112.364 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.526 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.91 -40.01 94.0 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.521 0.201 . . . . 95.379999999999995 110.836 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -63.44 -40.12 96.31 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.213 -0.449 . . . . 381.13999999999999 110.567 179.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.73 -42.69 96.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 115.996 -0.547 . . . . 182.12 110.517 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -70.33 -10.44 66.12 Favored Glycine 0 CA--C 1.522 0.488 0 CA-C-N 115.689 -0.687 . . . . 88.799999999999997 113.747 -179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.1 mmm180 -79.85 -13.92 59.05 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 117.107 0.454 . . . . 999.99000000000001 111.332 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -97.3 114.33 26.08 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.714 -0.476 . . . . 999.99000000000001 109.714 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.2 pt -121.8 23.27 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.325 -0.398 . . . . 308.67000000000002 111.817 -179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -81.64 77.94 8.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.995 0.426 . . . . 388.05000000000001 111.034 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 67.4 mtt -91.75 -2.65 56.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.059 -0.519 . . . . 360.56999999999999 110.817 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.31 -37.3 82.73 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.819 -0.628 . . . . 184.22999999999999 110.898 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -58.64 -44.94 90.23 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.472 -0.785 . . . . 999.99000000000001 111.205 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.67 -48.3 77.91 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.443 -0.344 . . . . 374.13 111.285 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -65.0 -39.84 94.06 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 999.99000000000001 111.051 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -63.34 -41.8 98.9 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.064 -0.516 . . . . 558.87 110.69 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.82 92.57 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.929 -0.578 . . . . 332.85000000000002 111.466 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.0 -42.07 99.75 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.43 -0.35 . . . . 472.20999999999998 110.862 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -63.72 -39.52 94.51 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 116.339 -0.392 . . . . 821.44000000000005 110.953 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -58.84 -39.8 82.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.063 -0.517 . . . . 746.24000000000001 111.545 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -84.56 -11.91 55.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.45 -0.341 . . . . 999.99000000000001 111.344 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.9 t30 54.38 42.96 31.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.953 -0.567 . . . . 675.44000000000005 111.524 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 63.3 tpp -127.87 118.64 24.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.829 0.347 . . . . 999.99000000000001 111.107 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.0 mt -94.82 119.04 66.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 390.38 110.085 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.27 140.48 37.22 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.243 1.962 . . . . 243.11000000000001 112.83 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -85.88 150.39 24.56 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.063 -0.517 . . . . 618.10000000000002 110.846 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.617 ' HB2' HG13 ' A' ' 45' ' ' VAL . 50.5 t80 -67.61 125.27 25.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.784 0.326 . . . . 999.99000000000001 110.483 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 89.8 mt -98.96 145.61 30.26 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.289 -0.414 . . . . 415.25 111.336 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.86 -24.43 53.84 Favored 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.637 2.225 . . . . 529.14999999999998 111.97 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -62.85 -34.92 78.35 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.502 -0.772 . . . . 516.88 110.915 179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.9 mtt -59.95 -39.5 85.78 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.091 -0.504 . . . . 914.60000000000002 110.483 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -61.44 -41.59 97.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.104 -0.498 . . . . 675.30999999999995 110.674 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -64.78 -42.18 95.28 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.074 -0.512 . . . . 900.95000000000005 110.828 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 33.8 mm -62.02 -46.65 96.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.088 -0.505 . . . . 300.73000000000002 111.07 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.5 -41.93 96.13 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.138 -0.483 . . . . 595.28999999999996 112.189 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -65.1 -35.81 82.31 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.448 0.536 . . . . 999.99000000000001 112.448 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.4 mtm -90.73 134.5 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.036 0.384 . . . . 385.68000000000001 112.036 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -53.09 146.13 21.41 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.668 -0.696 . . . . 999.99000000000001 111.755 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.24 -37.54 88.11 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 123.028 2.485 . . . . 149.59999999999999 112.949 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.77 -19.76 61.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.289 -0.414 . . . . 147.02000000000001 112.072 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -91.59 -21.67 20.71 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.185 0.439 . . . . 360.37 112.185 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.4 m -90.65 146.71 34.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 120.848 0.356 . . . . 187.93000000000001 111.306 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -72.53 156.73 53.75 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.702 2.268 . . . . 265.38999999999999 112.952 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.8 t -115.87 137.08 50.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.34 -0.615 . . . . 246.78 109.34 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -144.59 140.88 29.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.603 -0.271 . . . . 999.99000000000001 110.573 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -82.83 175.59 9.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.085 -0.507 . . . . 495.41000000000003 110.302 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.471 ' SD ' ' HA ' ' A' ' 60' ' ' THR . 27.9 ptm . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.3 -0.857 . . . . 761.34000000000003 110.961 -179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 87.4 mmt-85 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 111.831 0.308 . . . . 999.99000000000001 111.831 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.443 ' C ' ' H ' ' A' ' 4' ' ' HIS . 80.0 p -111.63 -13.34 13.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.651 0.262 . . . . 999.99000000000001 110.511 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.7 m0 68.54 -17.14 0.19 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.926 0.89 . . . . 999.99000000000001 112.658 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.443 ' H ' ' C ' ' A' ' 2' ' ' SER . 96.7 m-70 59.02 25.86 14.38 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.309 0.643 . . . . 999.99000000000001 112.138 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -145.65 -97.56 0.1 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.016 0.436 . . . . 999.99000000000001 110.885 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 71.3 t -119.68 125.36 74.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.007 -0.542 . . . . 375.51999999999998 110.354 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -82.46 147.44 56.25 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.477 -0.329 . . . . 999.99000000000001 110.901 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.71 152.41 47.66 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.73 2.287 . . . . 436.63 112.861 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -88.95 61.27 5.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.458 -0.337 . . . . 999.99000000000001 111.457 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 54.94 47.74 21.52 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.783 -0.644 . . . . 999.99000000000001 112.237 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 97.8 mt -56.68 142.27 40.68 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.322 -0.399 . . . . 781.60000000000002 111.064 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.37 114.06 19.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 216.75 111.102 -179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -64.12 -24.11 67.57 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.81 -0.632 . . . . 902.89999999999998 111.999 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.91 -39.16 84.48 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.885 0.374 . . . . 121.34999999999999 111.182 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -65.35 -34.88 79.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 265.05000000000001 109.965 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -64.15 -40.12 95.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.567 -0.742 . . . . 524.44000000000005 110.1 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.5 t -62.06 -46.87 95.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.774 -0.648 . . . . 214.56 111.186 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.04 -41.6 98.29 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.0 -0.546 . . . . 61.909999999999997 111.059 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 85' ' ' TYR . 62.4 tp -67.98 -41.03 82.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.844 -0.616 . . . . 321.58999999999997 111.428 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -58.98 -40.48 84.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.95 -0.568 . . . . 491.97000000000003 111.78 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.21 -43.78 98.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.726 0.298 . . . . 179.68000000000001 110.535 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.66 -39.12 91.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.393 . . . . 483.12 110.947 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.48 -42.37 95.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.153 -0.476 . . . . 120.91 110.603 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 91.9 mt -60.06 -41.14 85.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 CA-C-N 115.693 -0.685 . . . . 324.41000000000003 111.642 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.51 -43.29 93.43 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 111.724 0.268 . . . . 76.379999999999995 111.724 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.44 -41.82 97.85 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.684 -0.77 . . . . 59.560000000000002 112.515 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -74.26 -18.29 60.75 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.963 0.357 . . . . 169.43000000000001 111.963 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.422 ' HA ' HD12 ' A' ' 31' ' ' LEU . 34.0 t70 -75.79 -31.49 59.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.401 -0.363 . . . . 145.09 110.908 -178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.8 mmm180 -62.8 -39.71 95.08 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.366 -0.605 . . . . 779.76999999999998 109.366 178.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.65 -35.78 91.69 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.376 -0.829 . . . . 72.329999999999998 112.409 178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 54' ' ' ASN . 77.0 mt -61.88 -42.77 99.46 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.078 0.399 . . . . 213.66999999999999 112.078 -179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 33.5 m -74.23 -32.2 31.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 C-N-CA 120.651 -0.42 . . . . 275.81999999999999 111.298 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.09 -40.64 94.88 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.919 0.39 . . . . 545.0 110.576 178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.522 ' HZ3' HD22 ' A' ' 42' ' ' LEU . 59.0 t90 -66.44 -39.5 88.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.031 -0.532 . . . . 999.99000000000001 109.582 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.9 mt -62.13 -37.04 83.65 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.561 -0.745 . . . . 205.93000000000001 111.071 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.18 -36.66 84.36 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.644 0.259 . . . . 557.46000000000004 111.464 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.04 -51.62 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 N-CA-C 113.599 0.963 . . . . 284.56999999999999 113.599 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 42.9 m80 -108.55 -4.67 17.01 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.274 0.842 . . . . 350.44 113.274 -177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -71.28 -12.23 72.28 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.125 -0.559 . . . . 199.69999999999999 113.95 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -61.18 -40.22 93.09 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.818 0.309 . . . . 999.99000000000001 111.339 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 60.8 p -112.36 8.7 19.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.517 -0.31 . . . . 302.80000000000001 111.796 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 ' HZ3' ' A' ' 34' ' ' TRP . 30.0 tp -71.46 131.69 43.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.373 -0.376 . . . . 581.97000000000003 111.32 -179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 42.0 t -70.54 152.34 44.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.136 -0.483 . . . . 239.06999999999999 110.732 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.7 m -59.88 -41.48 91.64 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.184 -0.462 . . . . 192.00999999999999 111.367 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.407 HG23 ' H ' ' A' ' 45' ' ' VAL . 2.1 t -68.76 -37.35 77.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.885 0.374 . . . . 278.44999999999999 110.464 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.43 ' HG2' ' CZ ' ' A' ' 114' ' ' TYR . 97.5 mt-30 -64.13 -38.28 90.48 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.973 -0.558 . . . . 316.42000000000002 111.073 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.04 -45.11 93.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.191 -0.459 . . . . 470.35000000000002 110.682 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -63.47 -40.4 97.02 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.003 0.43 . . . . 369.77999999999997 110.408 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.17 -39.07 91.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.705 -0.68 . . . . 66.790000000000006 111.338 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.95 -44.13 94.58 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.932 -0.576 . . . . 238.30000000000001 111.78 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -62.21 -40.25 95.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 526.92999999999995 110.288 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -62.72 -44.78 95.35 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.129 -0.487 . . . . 162.88 110.012 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 56.7 t -60.36 -40.43 83.96 Favored 'Isoleucine or valine' 0 C--N 1.338 0.079 0 CA-C-N 115.903 -0.589 . . . . 139.00999999999999 110.097 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB2' HD21 ' A' ' 31' ' ' LEU . 28.9 t-20 -58.93 -45.34 90.63 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.387 -0.37 . . . . 198.61000000000001 110.714 179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -64.27 -42.46 96.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.762 0.315 . . . . 999.99000000000001 110.859 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -63.85 -44.71 92.35 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.234 0.54 . . . . 799.64999999999998 110.099 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -60.71 -46.95 88.43 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.249 -0.887 . . . . 151.58000000000001 110.936 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.9 ttp -59.45 -44.59 92.92 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.181 -0.463 . . . . 168.43000000000001 110.955 -179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -64.33 -42.23 96.39 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.882 0.372 . . . . 530.55999999999995 110.731 179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 90.1 m -64.72 -44.89 88.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.886 -0.597 . . . . 293.49000000000001 110.772 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -63.96 -44.92 91.34 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.783 -0.644 . . . . 383.72000000000003 110.268 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 55.7 t-105 -62.06 -45.1 95.05 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.65 -0.704 . . . . 497.0 111.713 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.45 79.66 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.396 0.517 . . . . 177.0 112.396 -178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -61.07 -48.54 81.27 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.643 0.259 . . . . 478.75999999999999 110.85 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -71.63 -39.02 70.69 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.29 -0.413 . . . . 727.09000000000003 111.612 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 28.1 ttt -52.16 -46.27 65.41 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.551 0.575 . . . . 664.46000000000004 112.551 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.66 -42.14 96.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.713 -0.221 . . . . 447.74000000000001 111.331 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -68.67 -40.14 80.28 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.977 0.418 . . . . 999.99000000000001 110.492 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.3 -44.13 98.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 115.6 -0.727 . . . . 398.94999999999999 110.496 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.85 -41.49 91.56 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.06 -0.518 . . . . 366.97000000000003 111.2 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -61.99 -42.33 99.02 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.53 -0.305 . . . . 709.00999999999999 110.682 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.9 -41.59 91.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.148 -0.478 . . . . 931.13999999999999 110.808 179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.541 HD13 ' HG3' ' A' ' 80' ' ' PRO . 95.0 mt -62.67 -46.23 96.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 115.911 -0.586 . . . . 175.25999999999999 110.663 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -61.59 -45.09 95.6 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.99 -0.55 . . . . 443.19 111.508 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.23 -41.01 99.05 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.47 -0.332 . . . . 366.44 111.764 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.94 -41.01 71.69 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.027 0.442 . . . . 386.93000000000001 111.345 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 89.33 -11.1 70.81 Favored Glycine 0 C--N 1.331 0.276 0 CA-C-N 115.875 -0.602 . . . . 244.66999999999999 112.504 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 12.6 mpt_? -75.64 145.7 40.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.782 0.325 . . . . 999.99000000000001 111.432 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.0 t -91.6 116.53 66.63 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-O 121.009 0.433 . . . . 263.29000000000002 110.567 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.541 ' HG3' HD13 ' A' ' 73' ' ' ILE . 69.6 Cg_endo -72.66 145.12 40.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.617 2.212 . . . . 173.88999999999999 113.304 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.6 m -102.07 178.47 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 201.66 110.849 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 70.0 t -60.83 -42.53 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 116.241 -0.436 . . . . 81.090000000000003 110.517 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.28 -39.58 96.24 Favored Glycine 0 C--N 1.334 0.468 0 C-N-CA 121.107 -0.568 . . . . 106.63 112.777 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -61.91 -40.58 95.95 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.023 0.439 . . . . 397.23000000000002 110.259 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD22 ' A' ' 19' ' ' LEU . 36.5 m-85 -67.44 -39.08 85.4 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.617 -0.719 . . . . 176.41 111.763 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.6 p -65.81 -34.81 79.03 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 111.9 0.333 . . . . 224.31999999999999 111.9 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -64.79 -41.54 95.76 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 121.005 0.431 . . . . 999.99000000000001 110.172 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -69.88 -40.5 75.65 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.698 -0.683 . . . . 158.16999999999999 110.623 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.8 -39.86 98.51 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.599 -0.728 . . . . 65.709999999999994 113.004 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.11 -41.21 96.28 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.662 0.267 . . . . 95.379999999999995 111.135 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.67 -40.82 97.8 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.262 -0.426 . . . . 381.13999999999999 110.674 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -64.45 -42.28 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.811 -0.631 . . . . 182.12 110.865 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.95 -16.85 62.4 Favored Glycine 0 CA--C 1.521 0.432 0 CA-C-N 115.933 -0.576 . . . . 88.799999999999997 113.542 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -79.85 -13.82 59.11 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.864 0.332 . . . . 999.99000000000001 111.227 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -108.22 114.71 28.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 999.99000000000001 110.584 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.403 HG22 ' H ' ' A' ' 98' ' ' MET . 75.6 mt -125.52 118.59 52.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 308.67000000000002 110.471 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -106.02 19.27 20.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.544 -0.298 . . . . 388.05000000000001 111.789 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.41 ' O ' ' HB3' ' A' ' 101' ' ' PHE . 98.0 mtp -62.29 -38.3 88.83 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.04 0.385 . . . . 360.56999999999999 112.04 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.1 -39.59 90.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.096 0.474 . . . . 184.22999999999999 110.551 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -73.75 -24.48 59.88 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.666 -0.697 . . . . 999.99000000000001 111.269 179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 98' ' ' MET . 86.8 t80 -58.16 -48.71 79.45 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.14 -0.482 . . . . 374.13 110.995 -179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -64.09 -39.46 94.1 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.393 -0.367 . . . . 999.99000000000001 111.005 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -61.92 -44.9 95.83 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.195 -0.457 . . . . 558.87 110.903 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.76 -41.23 99.13 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.104 -0.498 . . . . 332.85000000000002 111.319 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.1 mp -64.99 -45.12 86.92 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.159 -0.473 . . . . 472.20999999999998 111.258 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -64.61 -39.82 94.41 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.482 -0.326 . . . . 821.44000000000005 111.269 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.06 -43.89 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.162 -0.472 . . . . 746.24000000000001 111.99 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -91.38 -3.76 56.4 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.412 -0.358 . . . . 999.99000000000001 111.317 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.4 t30 57.53 37.44 27.66 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.235 0.614 . . . . 675.44000000000005 111.139 -179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 38.6 mmt -105.8 83.57 1.94 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.982 -0.554 . . . . 999.99000000000001 110.675 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.51 116.67 66.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.458 -0.337 . . . . 390.38 110.789 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.37 157.68 45.18 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.728 2.285 . . . . 243.11000000000001 112.651 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -80.12 126.27 30.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.464 -0.335 . . . . 618.10000000000002 110.348 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.43 ' CZ ' ' HG2' ' A' ' 46' ' ' GLN . 16.1 m-85 -70.03 90.96 0.66 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 999.99000000000001 111.33 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.5 mt -97.7 145.31 29.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.485 -0.325 . . . . 415.25 110.477 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -79.51 45.3 1.9 Allowed 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.493 2.129 . . . . 529.14999999999998 113.009 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -70.58 -29.22 65.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.077 -0.511 . . . . 516.88 110.393 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . 0.4 ' HA ' HG22 ' A' ' 121' ' ' ILE . 60.1 ttp -58.7 -43.31 90.02 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.608 -0.724 . . . . 914.60000000000002 111.113 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -61.11 -41.44 96.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.536 -0.302 . . . . 675.30999999999995 110.621 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -67.96 -41.22 82.78 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.011 -0.541 . . . . 900.95000000000005 111.911 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.4 HG22 ' HA ' ' A' ' 118' ' ' MET . 7.7 tp -73.52 -28.32 24.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 111.707 0.262 . . . . 300.73000000000002 111.707 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -70.21 -17.43 63.14 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.614 -0.266 . . . . 595.28999999999996 111.698 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 89.1 mmt-85 -65.04 -33.13 75.3 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.467 -0.333 . . . . 999.99000000000001 111.614 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 78.4 mtm -95.47 134.63 38.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.643 -0.253 . . . . 385.68000000000001 111.174 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.0 mtt-85 -52.53 139.34 39.0 Favored Pre-proline 0 N--CA 1.465 0.281 0 CA-C-N 116.203 -0.453 . . . . 999.99000000000001 110.851 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -60.22 -26.09 81.71 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.869 2.379 . . . . 149.59999999999999 113.274 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.71 -36.8 81.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 147.02000000000001 111.647 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -92.19 -1.2 57.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.389 -0.368 . . . . 360.37 111.961 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 62.5 t -87.15 120.5 71.43 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 120.684 0.278 . . . . 187.93000000000001 110.711 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.83 158.4 55.65 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.512 2.142 . . . . 265.38999999999999 112.311 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 88.0 t -106.0 137.59 35.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.207 -0.452 . . . . 246.78 110.109 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -78.93 116.56 19.32 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.023 0.44 . . . . 999.99000000000001 110.951 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -84.18 153.28 23.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.83 -0.623 . . . . 495.41000000000003 110.623 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 4.8 mtt . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.154 -0.927 . . . . 761.34000000000003 110.908 -179.891 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.585 ' HD3' HD22 ' A' ' 67' ' ' LEU . 44.0 ttm180 . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.698 0.285 . . . . 999.99000000000001 110.541 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 m -101.39 3.0 40.08 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.015 0.376 . . . . 999.99000000000001 112.015 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER 59.24 61.13 2.15 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.398 0.436 . . . . 999.99000000000001 111.726 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 45.5 p-80 -82.22 -1.02 47.86 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.203 -0.453 . . . . 999.99000000000001 111.767 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -81.53 -160.86 0.37 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.257 -0.429 . . . . 999.99000000000001 110.922 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 19.3 m -99.98 142.31 15.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.02 0.438 . . . . 375.51999999999998 111.116 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.87 150.67 66.1 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 115.985 -0.552 . . . . 999.99000000000001 110.482 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.467 ' HA ' ' OD2' ' A' ' 74' ' ' ASP . 50.5 Cg_endo -68.38 138.2 41.94 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.268 1.979 . . . . 436.63 112.687 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -102.59 -9.3 20.25 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.009 -0.542 . . . . 999.99000000000001 110.639 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -107.22 9.14 30.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.946 -0.57 . . . . 999.99000000000001 111.104 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 52.2 tp -57.13 125.92 24.87 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.987 -0.551 . . . . 781.60000000000002 111.104 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.8 t-20 -108.53 113.94 27.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.507 -0.315 . . . . 216.75 110.38 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 58.3 mtmt -62.48 -39.18 92.64 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.101 -0.5 . . . . 902.89999999999998 111.782 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.72 85.8 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.936 0.398 . . . . 121.34999999999999 111.54 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -71.34 -29.31 64.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.24 -0.437 . . . . 265.05000000000001 110.72 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.416 ' OE1' ' HA ' ' A' ' 13' ' ' LYS . 54.3 mt-10 -64.62 -40.72 95.99 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.899 -0.592 . . . . 524.44000000000005 112.115 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.723 HG11 ' HA ' ' A' ' 127' ' ' ALA . 27.8 m -68.7 -35.21 68.87 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 120.457 -0.497 . . . . 214.56 111.715 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.83 -41.55 95.98 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.002 0.43 . . . . 61.909999999999997 110.003 177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.748 HD11 ' HA3' ' A' ' 89' ' ' GLY . 58.1 tp -68.82 -40.42 79.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.691 -0.686 . . . . 321.58999999999997 111.132 178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -60.23 -38.01 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.04 -0.527 . . . . 491.97000000000003 111.881 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 69.0 t -63.04 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.622 0.249 . . . . 179.68000000000001 110.944 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -66.29 -41.52 89.68 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.644 0.259 . . . . 483.12 111.261 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.6 mt -70.09 -44.13 78.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 116.177 -0.465 . . . . 120.91 111.789 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.445 ' O ' ' HB2' ' A' ' 28' ' ' ASP . 6.3 tp -63.42 -33.9 64.09 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 CA-C-N 116.289 -0.414 . . . . 324.41000000000003 111.85 -178.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.57 -45.98 91.81 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.016 0.376 . . . . 76.379999999999995 112.016 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -67.28 -44.83 84.56 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.572 -0.823 . . . . 59.560000000000002 113.147 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-30 -72.65 -18.66 61.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.194 0.442 . . . . 169.43000000000001 112.194 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 24' ' ' ILE . 34.2 t70 -74.8 -39.48 61.68 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.1 -0.24 . . . . 145.09 111.561 -178.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.0 mtm180 -63.84 -41.34 97.84 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.616 -0.434 . . . . 779.76999999999998 110.174 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -41.02 99.84 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.831 -0.622 . . . . 72.329999999999998 112.078 178.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 63.7 tp -63.53 -44.42 94.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.682 0.277 . . . . 213.66999999999999 110.367 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.5 t -61.61 -44.6 98.92 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-N 116.11 -0.496 . . . . 275.81999999999999 110.813 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -62.24 -40.29 95.65 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.51 -0.314 . . . . 545.0 110.977 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.618 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 52.1 t90 -65.33 -42.01 93.38 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.398 -0.593 . . . . 999.99000000000001 109.398 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.432 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 86.6 mt -62.69 -35.49 79.88 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.271 -0.877 . . . . 205.93000000000001 111.296 179.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.94 -36.08 80.34 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.754 0.279 . . . . 557.46000000000004 111.754 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 58.4 t -86.31 -51.03 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 113.684 0.994 . . . . 284.56999999999999 113.684 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.619 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.2 m-70 -101.18 0.97 38.57 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.132 0.79 . . . . 350.44 113.132 -177.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.666 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -60.88 -36.48 92.11 Favored Glycine 0 N--CA 1.461 0.327 0 N-CA-C 114.095 0.398 . . . . 199.69999999999999 114.095 -179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -58.94 -39.42 81.57 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.818 0.303 . . . . 999.99000000000001 111.818 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -89.76 -10.19 46.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.861 0.689 . . . . 302.80000000000001 112.861 -179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.666 HD12 ' HA2' ' A' ' 39' ' ' GLY . 88.1 mt -73.0 138.38 45.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.89 0.376 . . . . 581.97000000000003 111.79 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.6 p -78.16 169.11 18.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.134 -0.485 . . . . 239.06999999999999 110.011 177.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.98 -42.27 98.05 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 120.751 0.31 . . . . 192.00999999999999 110.972 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.562 HG13 ' HB2' ' A' ' 114' ' ' TYR . 75.1 t -66.69 -43.26 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 116.232 -0.44 . . . . 278.44999999999999 111.145 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -63.19 -40.29 97.07 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 112.104 0.409 . . . . 316.42000000000002 112.104 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -61.09 -46.15 91.8 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.68 0.276 . . . . 470.35000000000002 111.061 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -70.67 -37.66 73.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.352 -0.385 . . . . 369.77999999999997 111.101 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.9 -36.77 80.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 66.790000000000006 111.888 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.55 -37.08 80.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 112.056 0.391 . . . . 238.30000000000001 112.056 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -61.56 -38.96 89.38 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.62 -0.511 . . . . 526.92999999999995 109.62 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -66.99 -39.32 87.13 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.742 -0.663 . . . . 162.88 109.481 178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.16 -39.6 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.544 -0.753 . . . . 139.00999999999999 111.062 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -58.31 -42.33 86.46 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.436 -0.347 . . . . 198.61000000000001 110.731 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 94.9 mtm-85 -66.35 -39.35 89.12 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 121.152 -0.219 . . . . 999.99000000000001 110.46 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -63.51 -38.67 92.02 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.227 0.537 . . . . 799.64999999999998 109.751 178.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.72 -46.4 89.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.06 -0.973 . . . . 151.58000000000001 109.555 178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 87.1 mtp -61.49 -42.99 99.63 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.768 -0.651 . . . . 168.43000000000001 110.865 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -62.72 -40.01 95.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.663 -0.699 . . . . 530.55999999999995 112.301 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.3 m -61.22 -49.32 77.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.734 0.302 . . . . 293.49000000000001 111.619 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -72.66 -39.31 67.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 383.72000000000003 111.92 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -64.58 -43.87 92.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 497.0 112.265 -178.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.64 -39.8 81.56 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.869 0.692 . . . . 177.0 112.869 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -60.8 -47.58 85.67 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.738 -0.21 . . . . 478.75999999999999 111.546 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.604 ' HB3' HD22 ' A' ' 88' ' ' LEU . 82.7 m-85 -71.28 -42.44 68.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.703 0.287 . . . . 727.09000000000003 111.77 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 96.9 mmm -56.39 -41.82 76.91 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 113.494 0.924 . . . . 664.46000000000004 113.494 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.585 HD22 ' HD3' ' A' ' 1' ' ' ARG . 65.2 tp -58.99 -46.62 87.69 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.189 0.44 . . . . 447.74000000000001 112.189 -177.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 50.5 m0 -65.63 -42.45 91.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.863 0.363 . . . . 999.99000000000001 111.267 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.532 HG13 HD11 ' A' ' 88' ' ' LEU . 49.2 mm -72.0 -43.77 67.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 116.016 -0.538 . . . . 398.94999999999999 112.098 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -61.35 -38.77 88.18 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 111.942 0.349 . . . . 366.97000000000003 111.942 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -59.96 -45.94 91.01 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.697 -0.483 . . . . 709.00999999999999 109.697 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -65.89 -40.97 92.05 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.894 -0.594 . . . . 931.13999999999999 110.972 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 92.5 mt -62.26 -48.09 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.34 -0.391 . . . . 175.25999999999999 111.2 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.467 ' OD2' ' HA ' ' A' ' 8' ' ' PRO . 95.5 m-20 -63.39 -42.63 98.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 443.19 111.712 -179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.51 -40.06 89.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 366.44 112.016 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.5 mp -74.68 -40.15 61.56 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.851 0.357 . . . . 386.93000000000001 111.55 179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 93.28 -9.95 73.94 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.152 -0.547 . . . . 244.66999999999999 112.827 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -75.31 133.94 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.381 -0.229 . . . . 999.99000000000001 110.381 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.8 p -73.93 139.38 76.61 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.785 -0.189 . . . . 263.29000000000002 111.12 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.58 145.05 32.7 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.505 2.136 . . . . 173.88999999999999 113.203 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.444 HG23 ' H ' ' A' ' 84' ' ' ASP . 16.7 m -102.68 170.23 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.936 -0.575 . . . . 201.66 110.854 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.92 -40.08 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.758 0.313 . . . . 81.090000000000003 110.461 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.1 -38.86 93.64 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 116.071 -0.513 . . . . 106.63 112.444 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.444 ' H ' HG23 ' A' ' 81' ' ' VAL . 37.8 t70 -61.66 -42.71 99.28 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.96 -0.385 . . . . 397.23000000000002 109.96 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.512 ' HB3' HD22 ' A' ' 19' ' ' LEU . 56.9 m-85 -66.3 -40.45 89.99 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.755 -0.657 . . . . 176.41 111.27 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.7 p -66.12 -32.98 74.76 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.595 0.22 . . . . 224.31999999999999 111.595 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.4 tpt180 -61.73 -46.07 91.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.405 -0.591 . . . . 999.99000000000001 109.405 178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 65' ' ' TYR . 92.9 mt -66.75 -40.74 88.41 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.465 -0.789 . . . . 158.16999999999999 110.347 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.748 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.61 -39.57 98.05 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.439 -0.8 . . . . 65.709999999999994 113.685 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -60.54 -40.48 91.7 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.695 0.283 . . . . 95.379999999999995 110.988 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -64.61 -40.5 95.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.981 -0.554 . . . . 381.13999999999999 110.241 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.5 mt -64.73 -43.43 96.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.56 -0.746 . . . . 182.12 111.146 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -67.24 -13.92 63.18 Favored Glycine 0 CA--C 1.52 0.397 0 CA-C-N 115.824 -0.625 . . . . 88.799999999999997 114.001 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -79.38 -15.66 57.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.305 0.552 . . . . 999.99000000000001 111.479 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -108.66 111.81 23.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 999.99000000000001 110.93 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 77.4 mt -124.47 120.35 58.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.809 -0.441 . . . . 308.67000000000002 109.809 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -152.6 55.21 0.8 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.693 0.282 . . . . 388.05000000000001 111.2 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.4 mmm -64.48 -38.83 92.39 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.009 -0.542 . . . . 360.56999999999999 111.704 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.98 -39.38 89.37 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 184.22999999999999 111.675 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -60.02 -47.52 85.51 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.918 -0.583 . . . . 999.99000000000001 111.637 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -57.75 -45.73 85.49 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.122 0.264 . . . . 374.13 111.062 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -59.56 -48.13 82.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.569 0.223 . . . . 999.99000000000001 110.546 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -62.94 -41.69 99.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.417 -0.356 . . . . 558.87 110.98 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.48 94.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.101 -0.5 . . . . 332.85000000000002 111.055 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 110' ' ' MET . 59.6 tp -61.07 -43.79 98.35 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.652 -0.703 . . . . 472.20999999999998 110.587 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -62.96 -39.84 95.87 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.189 -0.46 . . . . 821.44000000000005 110.557 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.38 -40.36 82.12 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.741 -0.663 . . . . 746.24000000000001 111.503 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -82.74 -11.52 58.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.324 -0.398 . . . . 999.99000000000001 111.507 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 58.9 t30 54.89 44.91 27.59 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.527 0.517 . . . . 675.44000000000005 111.576 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . 0.417 ' O ' HD11 ' A' ' 105' ' ' LEU . 66.9 mtt -115.39 83.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.292 -0.413 . . . . 999.99000000000001 110.878 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.8 mm -93.42 116.81 67.02 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 120.657 0.265 . . . . 390.38 110.642 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.54 150.31 45.56 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.718 2.279 . . . . 243.11000000000001 112.754 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -84.25 142.18 30.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 618.10000000000002 110.225 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.562 ' HB2' HG13 ' A' ' 45' ' ' VAL . 67.3 t80 -68.13 113.77 6.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.909 0.385 . . . . 999.99000000000001 110.653 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.7 mt -99.31 148.63 34.92 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 116.099 -0.5 . . . . 415.25 111.364 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.93 -19.2 58.33 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 122.841 2.361 . . . . 529.14999999999998 111.873 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -61.53 -35.88 78.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.566 -0.743 . . . . 516.88 110.855 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 17.8 tpt -58.41 -42.23 86.72 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.081 -0.508 . . . . 914.60000000000002 110.574 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.17 -40.4 93.76 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.16 -0.473 . . . . 675.30999999999995 110.429 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -63.66 -42.31 98.1 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.115 -0.493 . . . . 900.95000000000005 111.031 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 32.0 mm -61.67 -45.14 99.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.175 0 CA-C-N 116.433 -0.349 . . . . 300.73000000000002 110.807 178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.968 -0.56 . . . . 595.28999999999996 111.524 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -67.6 -33.66 75.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.293 0.479 . . . . 999.99000000000001 112.293 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.6 mtp -80.3 137.36 36.58 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 385.68000000000001 112.034 -179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.481 ' O ' HG23 ' A' ' 129' ' ' VAL . 96.2 mtt-85 -53.5 144.04 34.28 Favored Pre-proline 0 N--CA 1.466 0.371 0 CA-C-N 115.627 -0.715 . . . . 999.99000000000001 111.413 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -53.46 -33.77 68.89 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.116 2.544 . . . . 149.59999999999999 112.86 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.723 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -60.75 -35.94 77.66 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.066 -0.515 . . . . 147.02000000000001 111.809 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -91.27 0.97 57.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.41 -0.359 . . . . 360.37 111.944 -178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 125' ' ' ARG . 57.5 t -96.0 111.15 55.25 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.779 0.323 . . . . 187.93000000000001 110.811 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -77.04 163.05 31.29 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.782 2.321 . . . . 265.38999999999999 112.969 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.4 m -120.9 153.92 24.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.053 -0.521 . . . . 246.78 109.857 179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -116.75 124.06 48.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.041 0.448 . . . . 999.99000000000001 111.352 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -83.2 148.95 27.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 495.41000000000003 109.825 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.032 -0.985 . . . . 761.34000000000003 110.945 -179.503 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.405 ' NH1' ' H ' ' A' ' 132' ' ' LYS . 47.1 mtm180 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 120.51 0.195 . . . . 999.99000000000001 110.496 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -152.08 146.77 25.78 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.596 -0.274 . . . . 999.99000000000001 110.466 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 54.0 m0 -110.27 130.78 55.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.93 -0.396 . . . . 999.99000000000001 109.93 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.1 m170 -111.46 17.71 19.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.552 -0.295 . . . . 999.99000000000001 111.583 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -107.27 -99.46 0.36 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.687 0.28 . . . . 999.99000000000001 110.949 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.498 HG21 ' HG2' ' A' ' 71' ' ' LYS . 61.4 t -119.34 122.13 68.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.22 -0.289 . . . . 375.51999999999998 110.22 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 96.6 mt-10 -90.72 121.94 67.58 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.494 -0.321 . . . . 999.99000000000001 110.982 179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 48.6 Cg_exo -59.91 146.86 94.79 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.7 2.267 . . . . 436.63 112.06 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -61.64 -40.29 94.38 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.331 -0.395 . . . . 999.99000000000001 111.777 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -148.81 90.2 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.179 -0.208 . . . . 999.99000000000001 111.084 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 56.9 tp -58.98 122.91 14.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.276 -0.42 . . . . 781.60000000000002 110.381 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -101.43 102.65 13.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.921 0.391 . . . . 216.75 110.61 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -65.06 -38.51 91.04 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.799 -0.637 . . . . 902.89999999999998 112.052 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.46 -39.71 84.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.043 0.386 . . . . 121.34999999999999 112.043 -179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 110.018 -0.364 . . . . 265.05000000000001 110.018 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -63.89 -40.58 96.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.875 -0.602 . . . . 524.44000000000005 110.456 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -62.18 -47.32 93.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.963 -0.562 . . . . 214.56 111.19 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.56 -40.94 98.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.869 -0.605 . . . . 61.909999999999997 111.453 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.555 HD21 ' HB3' ' A' ' 85' ' ' TYR . 85.3 mt -69.06 -39.01 79.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.273 0.471 . . . . 321.58999999999997 112.273 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.561 ' HE3' HG21 ' A' ' 131' ' ' VAL . 6.3 mttm -57.56 -42.85 83.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.861 1.06 . . . . 491.97000000000003 113.861 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 29.6 m -65.29 -37.23 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.211 -0.595 . . . . 179.68000000000001 111.232 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -70.89 -39.89 72.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.948 0.404 . . . . 483.12 110.718 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.419 HG21 ' SD ' ' A' ' 58' ' ' MET . 96.7 mt -63.58 -43.64 98.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.672 -0.694 . . . . 120.91 111.177 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -59.64 -42.83 89.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.008 -0.542 . . . . 324.41000000000003 111.409 -178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.78 -44.51 96.7 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 121.042 -0.263 . . . . 76.379999999999995 111.385 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -66.26 -42.87 93.92 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 120.898 -0.668 . . . . 59.560000000000002 112.938 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -73.37 -20.15 60.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.959 0.355 . . . . 169.43000000000001 111.959 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -77.17 -33.89 56.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.662 -0.245 . . . . 145.09 110.732 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -61.55 -42.71 99.23 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 109.807 -0.442 . . . . 779.76999999999998 109.807 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.19 -38.67 82.82 Favored Glycine 0 CA--C 1.519 0.293 0 CA-C-N 115.846 -0.615 . . . . 72.329999999999998 112.141 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.9 tp -62.87 -44.64 95.58 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.238 0.458 . . . . 213.66999999999999 112.238 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.62 -31.79 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 C-N-CA 120.799 -0.36 . . . . 275.81999999999999 111.588 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -63.91 -40.79 97.31 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.918 0.39 . . . . 545.0 109.964 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -64.03 -43.85 94.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.599 -0.728 . . . . 999.99000000000001 109.904 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.76 -37.58 84.81 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 115.176 -0.92 . . . . 205.93000000000001 111.575 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -68.31 -20.28 64.74 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.983 0.364 . . . . 557.46000000000004 111.983 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.1 t -84.09 -41.45 16.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 120.914 0.388 . . . . 284.56999999999999 111.136 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -103.92 19.08 20.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.884 0.373 . . . . 350.44 110.895 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -58.51 -35.88 82.13 Favored Glycine 0 N--CA 1.459 0.228 0 CA-C-N 115.529 -0.76 . . . . 199.69999999999999 114.122 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -59.74 -39.59 85.25 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.936 0.346 . . . . 999.99000000000001 111.936 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.2 p -110.24 12.22 23.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.66 0.615 . . . . 302.80000000000001 112.66 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.474 HD22 ' HA ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -71.35 123.69 22.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 581.97000000000003 111.663 -179.328 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.462 ' HB2' ' HB2' ' A' ' 46' ' ' GLN . 70.7 m -78.67 154.66 29.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.092 -0.504 . . . . 239.06999999999999 110.491 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -61.1 -46.45 90.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.862 0.319 . . . . 192.00999999999999 111.862 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.5 t -73.01 -30.23 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 121.114 0.483 . . . . 278.44999999999999 110.452 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.462 ' HB2' ' HB2' ' A' ' 43' ' ' SER . 64.6 tt0 -60.62 -38.98 86.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.462 -0.79 . . . . 316.42000000000002 111.27 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -59.29 -46.32 88.87 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 110.342 -0.244 . . . . 470.35000000000002 110.342 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.43 -39.4 92.06 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.987 0.422 . . . . 369.77999999999997 110.595 179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.4 87.82 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.741 -0.663 . . . . 66.790000000000006 111.818 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -57.42 -37.01 72.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.269 -0.423 . . . . 238.30000000000001 111.975 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -63.75 -40.75 97.46 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.736 0.303 . . . . 526.92999999999995 110.217 179.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -64.96 -43.55 92.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.968 -0.56 . . . . 162.88 109.94 178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 68.6 t -61.19 -41.03 87.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 115.487 -0.779 . . . . 139.00999999999999 110.077 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -59.7 -42.72 93.64 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.91 -0.586 . . . . 198.61000000000001 110.272 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.404 ' NH1' ' HA ' ' A' ' 122' ' ' ASN . 99.2 mtt180 -63.71 -41.61 98.06 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.702 -0.227 . . . . 999.99000000000001 110.91 179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -62.13 -45.54 93.02 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.024 0.44 . . . . 799.64999999999998 110.064 179.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -60.4 -45.92 91.83 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.602 -0.726 . . . . 151.58000000000001 110.156 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.419 ' SD ' HG21 ' A' ' 23' ' ' ILE . 30.3 ttp -58.81 -42.92 90.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.304 -0.862 . . . . 168.43000000000001 110.821 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.33 -42.35 98.97 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.276 -0.42 . . . . 530.55999999999995 111.832 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 71.3 p -71.55 -39.09 70.89 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 111.69 0.255 . . . . 293.49000000000001 111.69 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -64.25 -45.83 86.42 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.139 0.495 . . . . 383.72000000000003 110.406 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 13.3 m95 -65.78 -39.65 91.2 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.691 -0.686 . . . . 497.0 112.538 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.63 -43.19 89.64 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.084 0.402 . . . . 177.0 112.084 -178.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -63.03 -47.41 83.18 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.858 0.361 . . . . 478.75999999999999 111.108 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.428 ' HE2' HD23 ' A' ' 88' ' ' LEU . 62.1 t80 -68.38 -44.34 75.38 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.053 -0.521 . . . . 727.09000000000003 111.326 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.2 ttp -53.56 -46.03 70.09 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.752 -0.658 . . . . 664.46000000000004 112.195 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.9 mt -61.54 -39.88 92.65 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.716 0.265 . . . . 447.74000000000001 111.716 -178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -62.07 -47.79 83.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.448 -0.342 . . . . 999.99000000000001 111.656 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 pt -80.42 -28.09 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 N-CA-C 112.671 0.619 . . . . 398.94999999999999 112.671 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -61.45 -40.2 93.65 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.526 0.203 . . . . 366.97000000000003 111.433 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.498 ' HG2' HG21 ' A' ' 6' ' ' VAL . 98.2 mttt -61.76 -42.18 98.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.488 -0.324 . . . . 709.00999999999999 110.592 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -67.96 -42.14 81.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.141 -0.481 . . . . 931.13999999999999 111.044 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.86 -46.91 92.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.291 -0.413 . . . . 175.25999999999999 111.063 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -63.37 -43.86 96.45 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.211 -0.449 . . . . 443.19 111.471 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.44 -39.98 95.93 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.214 -0.448 . . . . 366.44 111.823 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 6.8 mp -72.35 -40.68 67.16 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.473 -0.33 . . . . 386.93000000000001 111.173 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -8.17 79.55 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.89 -0.672 . . . . 244.66999999999999 112.706 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 86.0 mtp180 -74.23 142.83 45.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.787 0.327 . . . . 999.99000000000001 110.864 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 18.2 p -103.21 113.07 66.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.487 -0.324 . . . . 263.29000000000002 111.146 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.61 151.64 58.62 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.596 2.197 . . . . 173.88999999999999 112.829 179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -100.68 178.52 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.938 -0.574 . . . . 201.66 111.512 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 86' ' ' THR . 68.5 t -59.71 -43.41 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 115.868 -0.606 . . . . 81.090000000000003 110.937 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.27 -40.84 97.93 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.789 -0.72 . . . . 106.63 112.463 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.001 0.429 . . . . 397.23000000000002 110.154 178.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.555 ' HB3' HD21 ' A' ' 19' ' ' LEU . 22.5 m-85 -64.75 -39.08 93.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.618 -0.719 . . . . 176.41 112.044 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 82' ' ' VAL . 75.9 p -65.87 -33.13 75.12 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 111.829 0.307 . . . . 224.31999999999999 111.829 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -61.94 -47.09 86.44 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.089 0.471 . . . . 999.99000000000001 109.969 178.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.428 HD23 ' HE2' ' A' ' 65' ' ' TYR . 10.9 mp -70.12 -40.25 74.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.728 -0.669 . . . . 158.16999999999999 110.575 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.68 -39.75 97.84 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.74 -0.664 . . . . 65.709999999999994 112.81 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.14 93.13 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.738 0.304 . . . . 95.379999999999995 110.887 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.23 -40.84 94.59 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.129 -0.487 . . . . 381.13999999999999 110.173 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 88.1 mt -63.96 -43.11 97.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.818 . . . . 182.12 111.183 179.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.59 -24.88 66.57 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 116.156 -0.475 . . . . 88.799999999999997 113.578 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.3 mmt-85 -81.18 -12.67 59.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 0.329 . . . . 999.99000000000001 111.804 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 41.4 mmt180 -108.38 112.43 24.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.97 0.414 . . . . 999.99000000000001 111.366 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 43.4 pt -134.32 153.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 308.67000000000002 110.623 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -152.93 43.23 0.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.048 0.452 . . . . 388.05000000000001 110.664 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.7 mtp -65.23 -36.55 84.51 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.811 -0.631 . . . . 360.56999999999999 111.737 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.13 84.14 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.061 -0.518 . . . . 184.22999999999999 111.609 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.1 t80 -60.04 -48.41 81.83 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.551 -0.295 . . . . 999.99000000000001 110.694 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -43.53 98.55 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.274 -0.421 . . . . 374.13 110.338 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -60.07 -47.83 84.25 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.985 -0.552 . . . . 999.99000000000001 110.807 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.36 -40.31 93.83 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.252 -0.431 . . . . 558.87 110.899 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.7 -43.03 99.85 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.409 -0.359 . . . . 332.85000000000002 110.924 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.34 -40.81 94.11 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.048 -0.524 . . . . 472.20999999999998 110.663 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -62.97 -42.6 99.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.816 -0.629 . . . . 821.44000000000005 111.13 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -57.66 -42.39 83.44 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.97 -0.559 . . . . 746.24000000000001 111.744 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -91.0 1.77 56.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.524 -0.307 . . . . 999.99000000000001 111.352 -179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 57.96 41.65 24.1 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.237 0.615 . . . . 675.44000000000005 111.925 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.9 mtm -100.95 81.63 2.28 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.935 0.397 . . . . 999.99000000000001 110.513 179.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 73.2 mt -93.84 118.61 67.36 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.092 -0.503 . . . . 390.38 110.401 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.82 149.11 53.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.598 2.199 . . . . 243.11000000000001 112.717 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.71 135.92 33.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.242 -0.436 . . . . 618.10000000000002 110.436 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -68.73 109.36 3.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.851 0.357 . . . . 999.99000000000001 111.014 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 89.0 mt -97.23 125.08 46.98 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 415.25 111.237 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 77.2 Cg_exo -55.47 -31.96 80.33 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.277 2.651 . . . . 529.14999999999998 113.051 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -62.12 -36.52 81.99 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.371 -0.377 . . . . 516.88 111.091 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 61.1 mtt -60.31 -38.73 84.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.449 -0.341 . . . . 914.60000000000002 110.319 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.11 -39.44 89.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.932 -0.576 . . . . 675.30999999999995 110.291 178.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 124' ' ' MET . 97.9 mt-10 -64.03 -40.15 95.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.999 -0.546 . . . . 900.95000000000005 110.909 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.6 mt -61.42 -41.79 91.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.022 0.439 . . . . 300.73000000000002 110.45 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.404 ' HA ' ' NH1' ' A' ' 55' ' ' ARG . 99.4 m-20 -60.33 -37.34 80.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.955 -0.566 . . . . 595.28999999999996 110.89 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -74.74 -10.85 59.91 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.077 -0.511 . . . . 999.99000000000001 112.335 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 120' ' ' GLU . 65.4 mtt -77.38 119.91 21.66 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.982 -0.287 . . . . 385.68000000000001 110.786 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -52.98 120.72 20.34 Favored Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 116.015 -0.538 . . . . 999.99000000000001 112.012 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -58.92 -35.83 97.93 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.884 2.39 . . . . 149.59999999999999 112.827 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.32 -37.07 85.84 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.695 0.628 . . . . 147.02000000000001 112.695 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -90.84 -22.07 21.16 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.432 0.53 . . . . 360.37 112.432 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 124' ' ' MET . 62.0 t -105.34 109.02 62.73 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 121.028 -0.269 . . . . 187.93000000000001 110.774 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -59.85 138.98 85.99 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.476 2.117 . . . . 265.38999999999999 112.463 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.561 HG21 ' HE3' ' A' ' 20' ' ' LYS . 96.6 t -128.54 137.7 56.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.127 -0.488 . . . . 246.78 111.31 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.405 ' H ' ' NH1' ' A' ' 1' ' ' ARG . 58.9 mtmt -122.9 147.72 46.27 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.218 -0.66 . . . . 999.99000000000001 109.218 178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -83.52 125.72 32.05 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.727 0.298 . . . . 495.41000000000003 110.99 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 34.4 mtm . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.4 -0.81 . . . . 761.34000000000003 111.311 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.883 0.373 . . . . 999.99000000000001 110.74 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 m -103.43 97.25 7.33 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.837 -0.801 . . . . 999.99000000000001 108.837 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.419 ' HB2' ' O ' ' A' ' 134' ' ' MET . 34.7 p-90 -98.72 1.72 46.38 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.216 -0.447 . . . . 999.99000000000001 111.892 -178.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -149.73 148.89 29.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.702 -0.227 . . . . 999.99000000000001 110.461 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -65.62 -36.75 84.62 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.124 -0.489 . . . . 999.99000000000001 111.4 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.34 130.25 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.205 -0.452 . . . . 375.51999999999998 109.913 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -80.94 119.31 75.68 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.281 -0.418 . . . . 999.99000000000001 111.046 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -59.69 144.9 99.34 Favored 'Trans proline' 0 C--N 1.35 0.605 0 C-N-CA 122.973 2.449 . . . . 436.63 111.854 178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -120.35 151.42 39.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.822 0.344 . . . . 999.99000000000001 111.733 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 63.36 29.17 15.7 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.291 -0.868 . . . . 999.99000000000001 112.605 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.8 mt -57.99 128.22 36.02 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.641 0.258 . . . . 781.60000000000002 111.078 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -114.07 114.74 26.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.594 -0.276 . . . . 216.75 110.414 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.76 -39.39 94.0 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.252 -0.431 . . . . 902.89999999999998 111.635 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.91 87.6 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.409 -0.359 . . . . 121.34999999999999 111.642 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -68.37 -31.37 70.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 265.05000000000001 110.398 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -63.76 -39.91 95.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.909 -0.587 . . . . 524.44000000000005 110.679 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.8 t -62.13 -46.81 95.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.013 0.435 . . . . 214.56 110.86 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.57 93.99 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.626 -0.715 . . . . 61.909999999999997 110.596 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.814 HD13 ' HB3' ' A' ' 85' ' ' TYR . 65.1 tp -64.27 -45.28 88.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.602 -0.726 . . . . 321.58999999999997 111.883 178.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -61.77 -40.75 96.27 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.259 0.837 . . . . 491.97000000000003 113.259 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.65 -33.76 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 120.221 -0.591 . . . . 179.68000000000001 111.485 -179.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.05 -40.67 78.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.047 0.451 . . . . 483.12 109.898 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.15 -43.29 95.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-N 115.442 -0.799 . . . . 120.91 110.64 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.0 mt -60.88 -43.27 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.839 -0.619 . . . . 324.41000000000003 111.276 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -43.32 98.49 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 111.618 0.229 . . . . 76.379999999999995 111.618 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.24 -42.28 97.95 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.881 -0.676 . . . . 59.560000000000002 112.733 179.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -74.7 -18.29 60.54 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.8 0.333 . . . . 169.43000000000001 111.505 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -75.73 -31.79 59.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.344 -0.389 . . . . 145.09 110.912 -178.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -60.76 -46.08 91.83 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 109.465 -0.569 . . . . 779.76999999999998 109.465 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.98 93.56 Favored Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.605 -0.725 . . . . 72.329999999999998 111.751 178.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 tt -60.87 -48.27 82.59 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.428 -0.386 . . . . 213.66999999999999 111.655 -179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.89 -29.45 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 C-N-CA 120.929 -0.308 . . . . 275.81999999999999 111.214 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.528 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 64.2 tttm -62.41 -43.78 98.0 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-O 120.967 0.413 . . . . 545.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.792 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 27.5 t90 -70.22 -39.51 75.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.16 -0.473 . . . . 999.99000000000001 110.18 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.29 -38.42 91.09 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.619 0.6 . . . . 205.93000000000001 112.619 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -66.32 -19.17 65.74 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.885 -0.509 . . . . 557.46000000000004 111.431 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.11 -52.56 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 112.551 0.575 . . . . 284.56999999999999 112.551 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -111.6 -8.08 14.24 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.951 0.723 . . . . 350.44 112.951 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.64 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -67.82 -17.82 69.76 Favored Glycine 0 N--CA 1.46 0.241 0 C-N-CA 121.252 -0.499 . . . . 199.69999999999999 113.567 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -61.18 -39.37 89.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.752 0.31 . . . . 999.99000000000001 111.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.3 p -91.6 -8.22 47.92 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.688 0.625 . . . . 302.80000000000001 112.688 -179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.792 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 96.1 mt -72.8 141.86 48.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.884 0.373 . . . . 581.97000000000003 111.509 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.9 p -77.59 168.44 19.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.068 -0.514 . . . . 239.06999999999999 110.375 178.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 87.0 m -60.9 -40.44 93.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.881 0.372 . . . . 192.00999999999999 110.713 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.679 HG13 ' HB2' ' A' ' 114' ' ' TYR . 61.8 t -65.6 -44.28 93.79 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.004 -0.543 . . . . 278.44999999999999 110.946 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -63.99 -41.57 97.47 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.422 -0.354 . . . . 316.42000000000002 111.232 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -62.89 -46.32 88.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.458 -0.337 . . . . 470.35000000000002 110.825 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -65.09 -40.72 94.99 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.118 -0.492 . . . . 369.77999999999997 110.909 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.07 -36.19 78.95 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.859 -0.61 . . . . 66.790000000000006 111.499 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.5 tp -59.01 -39.18 81.09 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.043 -0.526 . . . . 238.30000000000001 111.327 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -60.77 -40.17 91.56 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.701 0.286 . . . . 526.92999999999995 110.527 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.506 ' HB2' ' SD ' ' A' ' 118' ' ' MET . 61.4 t80 -66.39 -39.75 89.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.219 -0.446 . . . . 162.88 109.887 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.7 t -60.99 -43.86 96.95 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-N 115.712 -0.676 . . . . 139.00999999999999 110.025 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.68 -40.4 91.99 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.903 -0.59 . . . . 198.61000000000001 109.98 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' MET . 77.4 ttt-85 -60.35 -47.91 84.01 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.808 -0.633 . . . . 999.99000000000001 110.757 178.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.4 mmm-85 -64.59 -40.77 96.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.098 0.475 . . . . 799.64999999999998 110.793 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -62.51 -48.16 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.663 -0.698 . . . . 151.58000000000001 112.48 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.499 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 4.9 ppp? -64.36 -38.37 90.79 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.172 0.804 . . . . 168.43000000000001 113.172 -178.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -71.41 -39.14 71.3 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.482 -0.487 . . . . 530.55999999999995 111.78 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.6 p -73.82 -41.33 62.47 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 111.72 0.267 . . . . 293.49000000000001 111.72 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -63.76 -45.87 87.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.834 0.35 . . . . 383.72000000000003 110.427 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.456 ' CZ2' HD21 ' A' ' 19' ' ' LEU . 74.9 t-105 -62.38 -47.56 83.6 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.896 -0.593 . . . . 497.0 111.729 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.57 -40.73 88.33 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.502 -0.317 . . . . 177.0 111.709 -179.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -61.41 -46.87 88.3 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.838 0.351 . . . . 478.75999999999999 110.709 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.51 -46.7 84.85 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 727.09000000000003 110.865 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.5 mmm -52.04 -19.66 2.0 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 114.183 1.179 . . . . 664.46000000000004 114.183 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 82.0 mt -59.77 -43.59 94.27 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 118.257 0.481 . . . . 447.74000000000001 110.587 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 26.6 t90 -68.43 -45.54 72.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.03 -0.532 . . . . 999.99000000000001 111.271 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.0 mm -67.95 -41.11 84.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 115.465 -0.789 . . . . 398.94999999999999 112.787 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -59.2 -39.15 81.73 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.052 0.39 . . . . 366.97000000000003 112.052 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -60.83 -42.28 97.42 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 121.042 -0.263 . . . . 709.00999999999999 110.955 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.29 -42.06 80.05 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.528 -0.306 . . . . 931.13999999999999 111.64 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.67 -47.99 88.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.53 -0.305 . . . . 175.25999999999999 111.291 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.31 -40.32 97.02 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.219 -0.446 . . . . 443.19 111.504 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.31 -40.74 96.54 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.495 -0.32 . . . . 366.44 111.51 179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.5 mt -69.26 -40.28 77.92 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.817 0.341 . . . . 386.93000000000001 111.279 179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.05 -8.48 79.75 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.978 -0.63 . . . . 244.66999999999999 112.776 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.6 mmt180 -74.57 145.63 43.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.61 0.243 . . . . 999.99000000000001 111.063 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 79.8 p -72.14 138.12 81.77 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.436 -0.347 . . . . 263.29000000000002 110.845 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 36.1 Cg_exo -61.51 135.36 56.62 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.537 2.158 . . . . 173.88999999999999 112.842 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.632 HG13 ' H ' ' A' ' 84' ' ' ASP . 12.2 p -104.07 150.58 7.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.467 -0.333 . . . . 201.66 110.235 178.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.4 t -62.93 -42.07 95.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 N-CA-C 111.974 0.361 . . . . 81.090000000000003 111.974 -179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.23 -43.13 97.42 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 120.906 -0.664 . . . . 106.63 113.546 -178.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.632 ' H ' HG13 ' A' ' 81' ' ' VAL . 36.9 t70 -63.89 -43.02 97.27 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.03 0.443 . . . . 397.23000000000002 110.435 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.814 ' HB3' HD13 ' A' ' 19' ' ' LEU . 3.9 m-30 -64.42 -41.12 96.78 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.545 -0.752 . . . . 176.41 111.774 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.5 p -67.91 -36.19 79.76 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 121.011 -0.276 . . . . 224.31999999999999 111.306 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -62.61 -45.99 90.34 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.223 0.535 . . . . 999.99000000000001 109.639 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 98.2 mt -65.72 -39.8 91.54 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 115.42 -0.809 . . . . 158.16999999999999 110.53 178.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.67 -39.71 97.78 Favored Glycine 0 C--N 1.335 0.475 0 CA-C-N 115.633 -0.712 . . . . 65.709999999999994 112.771 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.09 -40.71 94.75 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.651 0.262 . . . . 95.379999999999995 110.971 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -65.54 -40.65 93.12 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.144 0.497 . . . . 381.13999999999999 110.522 179.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.2 mm -65.52 -41.79 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 115.461 -0.791 . . . . 182.12 111.21 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.41 -16.96 61.32 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 115.899 -0.592 . . . . 88.799999999999997 113.707 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -79.78 -13.92 59.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 117.034 0.417 . . . . 999.99000000000001 111.362 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 60.8 ttt85 -108.58 119.81 40.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.772 0.32 . . . . 999.99000000000001 110.433 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.2 pt -129.82 156.02 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 308.67000000000002 111.483 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -136.21 21.62 3.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.344 0.592 . . . . 388.05000000000001 109.974 179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 98.5 mtp -64.54 -39.48 93.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.324 -0.853 . . . . 360.56999999999999 112.23 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.98 -40.88 97.11 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.246 0.461 . . . . 184.22999999999999 112.246 -179.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -78.5 -21.6 48.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.594 -0.275 . . . . 999.99000000000001 111.687 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.481 ' CE2' HD11 ' A' ' 105' ' ' LEU . 88.3 t80 -59.46 -46.76 87.86 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.474 -0.33 . . . . 374.13 111.013 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -62.0 -39.44 92.24 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.697 0.284 . . . . 999.99000000000001 110.902 179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -62.59 -42.72 99.73 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.112 -0.495 . . . . 558.87 110.23 179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.23 -40.24 95.47 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 115.802 -0.635 . . . . 332.85000000000002 111.092 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.481 HD11 ' CE2' ' A' ' 101' ' ' PHE . 88.9 mt -62.55 -42.12 99.34 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.355 -0.384 . . . . 472.20999999999998 110.835 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.66 -44.0 97.37 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.279 -0.419 . . . . 821.44000000000005 110.976 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -58.89 -39.92 82.85 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.032 -0.531 . . . . 746.24000000000001 111.935 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -92.17 -2.23 56.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.45 -0.341 . . . . 999.99000000000001 111.527 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.2 t30 56.66 43.71 24.99 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 123.64 0.588 . . . . 675.44000000000005 111.299 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 78.9 mtm -103.85 111.16 23.56 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.872 0.368 . . . . 999.99000000000001 111.371 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 72.3 mt -94.67 118.92 66.79 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 390.38 109.996 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.83 118.88 5.77 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.159 1.906 . . . . 243.11000000000001 112.937 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -85.75 142.88 28.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 618.10000000000002 110.623 179.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.679 ' HB2' HG13 ' A' ' 45' ' ' VAL . 86.9 t80 -67.36 125.78 27.18 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.721 0.296 . . . . 999.99000000000001 110.906 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.2 mt -99.53 144.7 28.78 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.269 -0.423 . . . . 415.25 110.87 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.25 -18.89 50.72 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.667 2.245 . . . . 529.14999999999998 112.056 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -62.61 -26.67 68.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.475 -0.784 . . . . 516.88 111.358 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . 0.506 ' SD ' ' HB2' ' A' ' 52' ' ' PHE . 93.9 mmm -59.88 -38.92 83.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.256 -0.429 . . . . 914.60000000000002 111.529 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -60.88 -40.87 94.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.573 -0.285 . . . . 675.30999999999995 110.73 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -65.35 -40.98 94.3 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.429 -0.35 . . . . 900.95000000000005 111.181 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 28.6 mm -61.91 -45.02 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.384 -0.371 . . . . 300.73000000000002 111.08 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.12 -39.69 95.43 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.024 0.379 . . . . 595.28999999999996 112.024 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -70.19 -33.18 71.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.973 0.731 . . . . 999.99000000000001 112.973 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 79.7 mtm -88.06 132.93 34.1 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.535 0.569 . . . . 385.68000000000001 112.535 -178.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 129' ' ' VAL . 40.9 mmt180 -53.77 145.54 30.68 Favored Pre-proline 0 N--CA 1.465 0.284 0 CA-C-N 115.586 -0.734 . . . . 999.99000000000001 110.874 178.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.61 -30.06 90.97 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.671 2.247 . . . . 149.59999999999999 112.884 -179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.73 -36.03 81.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.233 -0.439 . . . . 147.02000000000001 111.234 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -91.98 0.48 57.47 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.552 0.575 . . . . 360.37 112.552 -178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 125' ' ' ARG . 66.3 t -83.13 116.6 65.15 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 187.93000000000001 110.964 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.56 156.34 49.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.821 2.348 . . . . 265.38999999999999 112.696 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 m -129.61 159.93 41.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-N 116.13 -0.486 . . . . 246.78 110.564 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -118.12 136.04 53.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.976 0.417 . . . . 999.99000000000001 111.521 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.3 165.64 18.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 495.41000000000003 110.349 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.419 ' O ' ' HB2' ' A' ' 3' ' ' TRP . 3.4 mtt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.158 -0.925 . . . . 761.34000000000003 111.082 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 82.5 mtp180 . . . . . 0 N--CA 1.475 0.8 0 CA-C-O 120.773 0.32 . . . . 999.99000000000001 110.82 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.8 m -110.18 108.89 19.2 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.169 -0.678 . . . . 999.99000000000001 109.169 178.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 2.9 t-105 -113.32 -141.55 0.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.559 -0.292 . . . . 999.99000000000001 110.803 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.4 m170 68.02 -118.8 0.19 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.408 0.442 . . . . 999.99000000000001 110.568 -179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 63.27 -92.16 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.867 0.467 . . . . 999.99000000000001 111.632 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.0 t -119.72 127.55 75.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.815 0.341 . . . . 375.51999999999998 110.809 -179.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -90.2 120.39 69.17 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 999.99000000000001 110.341 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.28 147.73 53.85 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.661 2.241 . . . . 436.63 112.906 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -157.16 -25.58 0.09 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.047 -0.524 . . . . 999.99000000000001 111.579 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -87.19 -12.63 46.3 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.288 0.477 . . . . 999.99000000000001 112.288 -179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 95.8 mt -57.63 139.25 54.09 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.099 0.476 . . . . 781.60000000000002 112.036 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -100.52 123.57 44.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.771 -0.65 . . . . 216.75 110.008 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.45 -38.82 88.58 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.176 -0.466 . . . . 902.89999999999998 111.282 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.78 -39.77 86.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.404 -0.362 . . . . 121.34999999999999 111.562 179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.2 m-30 -68.51 -32.7 72.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 265.05000000000001 110.061 179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -64.47 -38.62 91.65 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.8 -0.637 . . . . 524.44000000000005 110.018 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -60.71 -45.12 98.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-N 115.663 -0.699 . . . . 214.56 110.724 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.11 94.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 61.909999999999997 110.68 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.564 HD21 ' HB3' ' A' ' 85' ' ' TYR . 84.8 mt -65.81 -38.59 89.36 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.899 -0.591 . . . . 321.58999999999997 111.566 178.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -60.61 -38.19 83.9 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.207 -0.452 . . . . 491.97000000000003 111.695 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 78.9 t -62.95 -43.6 99.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 179.68000000000001 110.43 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.76 -41.48 97.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.208 -0.451 . . . . 483.12 110.767 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 94.6 mt -64.41 -43.54 97.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.876 -0.602 . . . . 120.91 110.88 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.32 -40.81 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 115.726 -0.67 . . . . 324.41000000000003 111.64 -179.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.85 -43.32 94.69 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 111.631 0.234 . . . . 76.379999999999995 111.631 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.41 -42.62 97.56 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.677 -0.773 . . . . 59.560000000000002 112.537 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -72.41 -19.91 61.52 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 111.97 0.359 . . . . 169.43000000000001 111.97 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -76.32 -31.96 58.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.612 -0.267 . . . . 145.09 111.263 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 41.0 mmt180 -61.57 -42.48 98.9 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.894 0.378 . . . . 779.76999999999998 110.176 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.37 -37.17 70.18 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.992 -0.549 . . . . 72.329999999999998 112.195 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 66.5 tp -60.71 -46.27 91.03 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.341 0.497 . . . . 213.66999999999999 112.341 -178.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.1 m -68.72 -26.68 33.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 112.37 0.507 . . . . 275.81999999999999 112.37 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 48.5 mmtm -63.6 -43.12 97.84 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.711 0.291 . . . . 545.0 111.072 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.453 ' HE1' ' HB2' ' A' ' 99' ' ' ALA . 86.2 m95 -81.14 -28.06 35.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.732 0.301 . . . . 999.99000000000001 111.128 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.84 -43.87 97.7 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 115.851 -0.613 . . . . 205.93000000000001 111.537 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -70.89 -20.87 62.46 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.822 0.304 . . . . 557.46000000000004 111.822 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 89.8 t -87.59 -49.75 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.498 0.555 . . . . 284.56999999999999 112.498 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -101.47 8.75 41.93 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.449 0.537 . . . . 350.44 112.449 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.86 -38.9 96.08 Favored Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.333 -0.461 . . . . 199.69999999999999 113.719 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.529 ' HG3' HG23 ' A' ' 41' ' ' THR . 17.7 ptm180 -64.43 -23.65 67.36 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.493 0.553 . . . . 999.99000000000001 112.493 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.529 HG23 ' HG3' ' A' ' 40' ' ' ARG . 54.5 p -112.36 1.99 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.085 0.402 . . . . 302.80000000000001 112.085 -179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.0 tp -72.52 124.4 25.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.433 -0.348 . . . . 581.97000000000003 111.21 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.6 m -77.93 156.36 30.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.34 -0.391 . . . . 239.06999999999999 110.858 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.4 m -61.08 -42.84 99.24 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.376 -0.375 . . . . 192.00999999999999 111.013 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.592 HG13 ' HB2' ' A' ' 114' ' ' TYR . 66.7 t -66.09 -42.07 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 116.166 -0.47 . . . . 278.44999999999999 110.597 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -62.98 -40.52 97.98 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.066 -0.516 . . . . 316.42000000000002 111.222 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.76 -47.71 85.07 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.43 -0.35 . . . . 470.35000000000002 110.995 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -66.24 -40.8 90.48 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.879 0.371 . . . . 369.77999999999997 110.953 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.63 93.91 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.796 -0.638 . . . . 66.790000000000006 111.881 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -59.3 -39.54 83.34 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.225 -0.443 . . . . 238.30000000000001 112.12 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.2 m-85 -62.75 -43.4 98.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.884 -0.326 . . . . 526.92999999999995 110.232 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.62 -48.23 80.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.956 -0.565 . . . . 162.88 110.526 178.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.417 HG11 ' CZ ' ' A' ' 101' ' ' PHE . 69.2 t -61.76 -42.19 93.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.116 0 CA-C-N 115.52 -0.764 . . . . 139.00999999999999 111.408 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -58.89 -45.77 89.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.688 -0.233 . . . . 198.61000000000001 111.456 -179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 89.0 mtm180 -65.1 -42.13 94.33 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.943 -0.303 . . . . 999.99000000000001 111.211 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.97 -40.94 95.75 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.214 0.531 . . . . 799.64999999999998 110.57 178.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -61.21 -46.3 91.02 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.295 -0.866 . . . . 151.58000000000001 110.415 179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 42.3 ttp -60.43 -40.07 89.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.617 -0.719 . . . . 168.43000000000001 110.998 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 76.6 mt-30 -61.99 -39.79 93.44 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 112.584 0.587 . . . . 530.55999999999995 112.584 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 74.1 p -65.51 -41.74 92.84 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 120.681 -0.408 . . . . 293.49000000000001 111.584 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.448 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 77.9 m-70 -71.06 -40.14 71.82 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.859 0.362 . . . . 383.72000000000003 110.775 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' A' ' 66' ' ' MET . 69.3 t-105 -62.12 -46.02 90.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.882 -0.599 . . . . 497.0 110.944 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.06 -39.91 83.56 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.22 -0.445 . . . . 177.0 111.567 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -60.6 -45.4 94.13 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.269 -0.423 . . . . 478.75999999999999 111.005 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 57.1 m-85 -68.45 -39.29 81.52 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.269 -0.423 . . . . 727.09000000000003 111.199 179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' TRP . 92.9 mmm -55.24 -41.17 71.76 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.413 0.523 . . . . 664.46000000000004 112.413 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.2 tp -59.72 -47.71 84.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.826 0.346 . . . . 447.74000000000001 110.473 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.2 t90 -64.96 -45.94 83.63 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.071 -0.513 . . . . 999.99000000000001 110.828 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.6 -46.82 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.734 -0.666 . . . . 398.94999999999999 111.89 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -61.86 -40.97 97.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.831 -0.168 . . . . 366.97000000000003 111.435 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -62.45 -45.88 91.06 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.442 -0.345 . . . . 709.00999999999999 110.657 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.5 tptm -62.11 -46.55 88.53 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.019 -0.537 . . . . 931.13999999999999 111.075 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.0 mt -62.93 -44.25 99.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.1 -0.5 . . . . 175.25999999999999 111.118 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -60.43 -44.18 96.05 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.344 -0.389 . . . . 443.19 111.222 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.48 97.17 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.492 -0.322 . . . . 366.44 111.476 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.01 -40.34 75.31 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.364 -0.38 . . . . 386.93000000000001 111.494 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 85.61 -4.91 85.08 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 116.068 -0.515 . . . . 244.66999999999999 112.351 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 89.7 mmt-85 -75.6 154.71 36.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 999.99000000000001 111.435 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.7 p -110.44 95.68 23.67 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 263.29000000000002 110.394 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.77 151.89 57.93 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.799 2.333 . . . . 173.88999999999999 113.703 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 16.6 m -100.79 -176.5 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.605 -0.725 . . . . 201.66 110.863 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.428 ' O ' HG23 ' A' ' 86' ' ' THR . 70.9 t -60.03 -42.24 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.384 -0.371 . . . . 81.090000000000003 111.01 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -40.05 96.12 Favored Glycine 0 C--N 1.334 0.44 0 C-N-CA 120.848 -0.692 . . . . 106.63 112.814 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.52 -41.89 96.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.078 0.466 . . . . 397.23000000000002 110.348 178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 19' ' ' LEU . 38.0 m-85 -67.14 -37.56 84.01 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.611 -0.722 . . . . 176.41 112.032 179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 82' ' ' VAL . 70.3 p -64.96 -28.54 69.59 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.376 0.51 . . . . 224.31999999999999 112.376 -179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.3 ttp-105 -61.85 -46.35 89.81 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.579 -0.526 . . . . 999.99000000000001 109.579 178.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.83 -40.08 83.79 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.545 -0.752 . . . . 158.16999999999999 110.393 178.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.78 98.22 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.605 -0.725 . . . . 65.709999999999994 112.902 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.15 -40.61 94.5 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.543 0.211 . . . . 95.379999999999995 111.097 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.76 -40.23 94.94 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.271 -0.422 . . . . 381.13999999999999 110.408 179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.69 -43.64 98.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.854 -0.612 . . . . 182.12 110.558 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.97 -21.21 65.43 Favored Glycine 0 C--N 1.333 0.379 0 CA-C-N 115.884 -0.598 . . . . 88.799999999999997 113.447 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 85.7 mtp180 -80.14 -17.04 53.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.892 0.346 . . . . 999.99000000000001 111.196 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mmt-85 -109.2 112.73 25.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.794 0.331 . . . . 999.99000000000001 110.725 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.3 pt -130.3 156.22 42.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.877 0.37 . . . . 308.67000000000002 111.079 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -141.01 34.12 1.74 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.247 0.546 . . . . 388.05000000000001 110.094 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 99.2 mtp -66.77 -34.26 77.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.427 -0.806 . . . . 360.56999999999999 111.578 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.453 ' HB2' ' HE1' ' A' ' 34' ' ' TRP . . . -59.6 -38.32 80.95 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.253 -0.431 . . . . 184.22999999999999 110.941 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.1 -42.0 93.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.636 -0.711 . . . . 999.99000000000001 110.59 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.417 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 85.4 t80 -58.02 -47.33 83.39 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.967 -0.56 . . . . 374.13 111.505 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -60.41 -42.9 96.95 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.625 0.25 . . . . 999.99000000000001 110.939 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.69 -45.47 78.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.292 -0.413 . . . . 558.87 110.956 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.22 -40.18 96.73 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.866 -0.606 . . . . 332.85000000000002 112.088 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.7 tp -60.59 -49.4 77.67 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.516 -0.311 . . . . 472.20999999999998 110.705 -179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -63.7 -39.27 93.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.814 0.34 . . . . 821.44000000000005 111.093 178.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -57.96 -39.88 79.19 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.921 -0.582 . . . . 746.24000000000001 111.817 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -82.55 -11.29 58.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.896 0.332 . . . . 999.99000000000001 111.896 -179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 53.51 43.03 31.81 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.394 0.434 . . . . 675.44000000000005 111.79 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -118.27 121.61 40.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.746 0.308 . . . . 999.99000000000001 110.52 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.3 mt -94.66 116.42 66.37 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.421 -0.354 . . . . 390.38 110.226 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.56 136.41 71.02 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.651 2.234 . . . . 243.11000000000001 112.617 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -85.46 134.42 34.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.425 . . . . 618.10000000000002 110.579 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.592 ' HB2' HG13 ' A' ' 45' ' ' VAL . 72.8 t80 -68.24 116.99 9.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.795 0.331 . . . . 999.99000000000001 110.551 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 93.9 mt -99.38 147.67 33.64 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.31 -0.404 . . . . 415.25 110.772 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.03 -28.61 66.0 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.542 2.161 . . . . 529.14999999999998 112.098 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -64.23 -37.91 89.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.861 -0.609 . . . . 516.88 110.813 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 67.0 mtt -59.6 -42.05 91.69 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-N 116.049 -0.523 . . . . 914.60000000000002 110.4 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -61.81 -44.72 96.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.125 -0.489 . . . . 675.30999999999995 110.817 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -64.63 -45.05 88.49 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.899 -0.592 . . . . 900.95000000000005 112.462 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.421 ' HA ' ' SD ' ' A' ' 124' ' ' MET . 17.8 tt -72.91 -25.18 21.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 120.735 0.302 . . . . 300.73000000000002 111.719 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -62.13 -37.99 87.24 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.97 0.414 . . . . 595.28999999999996 111.139 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -85.44 -0.7 55.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.083 -0.508 . . . . 999.99000000000001 111.785 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 121' ' ' ILE . 99.0 mtp -90.15 125.66 35.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.606 0.241 . . . . 385.68000000000001 111.291 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.507 ' O ' HG23 ' A' ' 129' ' ' VAL . 99.5 mtt180 -53.19 141.48 40.63 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-N 115.982 -0.554 . . . . 999.99000000000001 111.035 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -53.56 -36.63 81.2 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.982 2.454 . . . . 149.59999999999999 112.715 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.6 -34.86 76.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.923 -0.58 . . . . 147.02000000000001 111.781 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.85 0.27 57.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.229 0.455 . . . . 360.37 112.229 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.3 t -85.57 117.02 67.94 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.749 0.309 . . . . 187.93000000000001 110.624 179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.35 155.58 55.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.573 2.182 . . . . 265.38999999999999 112.889 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.5 t -113.77 136.86 48.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 246.78 109.843 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -115.49 131.49 56.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.85 0.357 . . . . 999.99000000000001 111.317 -179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 13.3 m-30 -81.35 152.23 27.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.057 -0.52 . . . . 495.41000000000003 110.565 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.7 mtp . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.22 -0.895 . . . . 761.34000000000003 110.667 -179.699 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 49.8 mmm-85 . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 120.548 0.213 . . . . 999.99000000000001 111.306 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.0 m 54.41 -118.52 1.32 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.876 -0.602 . . . . 999.99000000000001 111.558 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -153.5 174.49 14.35 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.415 . . . . 999.99000000000001 109.878 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 55.6 m170 -105.17 166.39 10.43 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.798 0.332 . . . . 999.99000000000001 111.308 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -67.87 -28.21 67.34 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.828 -0.624 . . . . 999.99000000000001 110.722 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.9 t -99.89 131.46 47.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.749 -0.659 . . . . 375.51999999999998 109.653 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 46.3 mp0 -80.21 121.33 81.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 999.99000000000001 110.77 -178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 47.8 Cg_exo -60.23 141.91 97.03 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.002 2.468 . . . . 436.63 112.709 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -74.36 143.94 44.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.511 . . . . 999.99000000000001 110.295 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -91.23 102.91 15.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.936 0.398 . . . . 999.99000000000001 110.718 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.0 mp -57.82 149.66 21.93 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.638 -0.71 . . . . 781.60000000000002 111.509 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -65.2 145.73 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.877 -0.416 . . . . 216.75 109.877 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.25 -45.14 91.98 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.615 -0.266 . . . . 902.89999999999998 111.187 -178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.35 88.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.5 -0.318 . . . . 121.34999999999999 111.615 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.9 m-30 -67.89 -35.22 78.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.147 -0.478 . . . . 265.05000000000001 110.213 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.446 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 95.8 mt-10 -65.18 -38.9 91.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.822 -0.626 . . . . 524.44000000000005 110.161 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.1 -45.6 95.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 115.823 -0.626 . . . . 214.56 111.104 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.12 98.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.898 -0.592 . . . . 61.909999999999997 111.001 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.5 mt -69.05 -38.85 79.35 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.939 -0.573 . . . . 321.58999999999997 111.948 179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 62.4 mtpt -60.74 -39.37 88.43 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.39 0.515 . . . . 491.97000000000003 112.39 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.81 -44.66 99.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.709 0.29 . . . . 179.68000000000001 110.841 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -65.96 -40.29 91.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.415 -0.357 . . . . 483.12 111.335 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 91.7 mt -65.88 -45.05 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 120.918 0.39 . . . . 120.91 110.829 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.96 -42.59 93.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 115.886 -0.597 . . . . 324.41000000000003 111.323 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.37 -44.32 95.72 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 121.115 -0.234 . . . . 76.379999999999995 111.138 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.72 -42.6 95.2 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 120.81 -0.71 . . . . 59.560000000000002 112.653 178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -71.61 -19.61 62.09 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.626 0.37 . . . . 169.43000000000001 111.916 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -76.39 -29.01 56.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.828 -0.169 . . . . 145.09 110.887 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.59 -40.56 97.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.878 0.371 . . . . 779.76999999999998 110.56 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.21 -29.53 40.7 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.703 -0.76 . . . . 72.329999999999998 112.492 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -64.5 -43.13 95.07 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.927 0.343 . . . . 213.66999999999999 111.927 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.448 ' HA ' HD12 ' A' ' 35' ' ' LEU . 26.8 m -64.72 -26.09 39.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 112.388 0.514 . . . . 275.81999999999999 112.388 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -61.84 -43.12 99.49 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.551 0.215 . . . . 545.0 110.85 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.7 m95 -72.2 -35.78 69.02 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.061 0.457 . . . . 999.99000000000001 110.439 178.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 32' ' ' VAL . 93.0 mt -62.91 -38.43 90.91 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.524 -0.762 . . . . 205.93000000000001 111.555 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -68.88 -24.02 64.28 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.661 0.245 . . . . 557.46000000000004 111.661 179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.6 t -85.75 -46.48 16.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 112.233 0.457 . . . . 284.56999999999999 112.233 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -101.29 8.51 42.4 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.421 0.526 . . . . 350.44 112.421 -178.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.48 -26.54 69.72 Favored Glycine 0 CA--C 1.519 0.312 0 C-N-CA 121.483 -0.389 . . . . 199.69999999999999 113.827 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -61.61 -40.2 93.97 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.772 0.286 . . . . 999.99000000000001 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.0 p -112.96 14.18 19.65 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.037 0.384 . . . . 302.80000000000001 112.037 -179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.4 tp -71.12 123.53 22.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.983 0.42 . . . . 581.97000000000003 111.515 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 68.4 m -79.59 159.98 26.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.966 -0.561 . . . . 239.06999999999999 110.865 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.7 m -60.92 -44.98 96.44 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.335 -0.393 . . . . 192.00999999999999 111.456 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.424 HG22 ' H ' ' A' ' 45' ' ' VAL . 1.3 m -71.03 -29.44 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 N-CA-C 112.256 0.465 . . . . 278.44999999999999 112.256 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.69 -40.08 94.77 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 121.216 -0.194 . . . . 316.42000000000002 110.987 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.9 tttp -61.38 -46.68 89.19 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.86 0.362 . . . . 470.35000000000002 110.136 178.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -64.45 -39.1 93.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.953 -0.567 . . . . 369.77999999999997 110.649 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.54 90.52 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 115.848 -0.615 . . . . 66.790000000000006 110.755 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.05 -39.12 93.38 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.084 -0.507 . . . . 238.30000000000001 111.336 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.475 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 43.4 m-85 -63.18 -38.94 93.17 Favored 'General case' 0 C--O 1.232 0.162 0 N-CA-C 109.249 -0.648 . . . . 526.92999999999995 109.249 177.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -61.09 -47.57 85.71 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.454 -0.793 . . . . 162.88 109.678 177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.5 t -62.86 -41.94 94.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 115.991 -0.55 . . . . 139.00999999999999 110.288 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -59.43 -43.1 93.14 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.949 -0.569 . . . . 198.61000000000001 111.053 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' HG2' HE21 ' A' ' 59' ' ' GLN . 48.2 ttp180 -61.04 -46.97 88.54 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 120.824 0.345 . . . . 999.99000000000001 110.508 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -62.74 -44.57 95.86 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.974 -0.557 . . . . 799.64999999999998 110.464 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.22 -48.11 83.1 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.505 -0.77 . . . . 151.58000000000001 111.232 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 43.9 ttp -60.74 -45.67 93.4 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.202 -0.453 . . . . 168.43000000000001 111.379 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.411 HE21 ' HG2' ' A' ' 55' ' ' ARG . 75.3 mt-30 -64.82 -41.12 96.02 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.062 -0.255 . . . . 530.55999999999995 111.063 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -63.68 -45.94 87.8 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.374 -0.375 . . . . 293.49000000000001 110.693 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.5 t-160 -62.55 -46.28 89.1 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.894 -0.594 . . . . 383.72000000000003 110.132 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -61.51 -47.76 84.16 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.818 -0.628 . . . . 497.0 111.304 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.61 -43.93 93.57 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.419 0.525 . . . . 177.0 112.419 -179.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -43.38 96.79 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 110.187 -0.301 . . . . 478.75999999999999 110.187 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -65.44 -44.26 87.86 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.185 -0.461 . . . . 727.09000000000003 110.185 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 tpt -53.53 -45.35 69.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.428 -0.805 . . . . 664.46000000000004 111.806 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.2 mp -60.88 -40.92 94.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.657 0.243 . . . . 447.74000000000001 111.657 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -63.04 -47.2 84.04 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.398 -0.364 . . . . 999.99000000000001 111.758 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 44.8 pt -77.44 -23.05 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.259 0.466 . . . . 398.94999999999999 112.259 -179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -58.99 -39.24 81.18 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.464 -0.335 . . . . 366.97000000000003 111.414 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -60.99 -43.26 99.12 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.665 0.269 . . . . 709.00999999999999 110.753 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -66.0 -45.08 82.86 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.255 -0.429 . . . . 931.13999999999999 110.758 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 37.8 mm -62.85 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.816 -0.629 . . . . 175.25999999999999 111.327 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -62.04 -43.61 98.46 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.31 -0.404 . . . . 443.19 111.368 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.45 97.66 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.498 -0.319 . . . . 366.44 111.462 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.9 mt -69.15 -40.67 78.07 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.894 0.378 . . . . 386.93000000000001 111.168 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.91 -9.77 75.29 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.053 -0.521 . . . . 244.66999999999999 112.675 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 41.7 mmt180 -75.26 147.79 39.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.891 0.377 . . . . 999.99000000000001 111.338 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 12.1 p -102.02 106.3 46.92 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 263.29000000000002 110.51 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.11 145.4 49.33 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.628 2.219 . . . . 173.88999999999999 113.473 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.7 m -101.66 -175.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.486 -0.779 . . . . 201.66 111.236 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.0 t -59.61 -40.58 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.333 -0.394 . . . . 81.090000000000003 110.81 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.631 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.09 -40.29 96.92 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.889 -0.672 . . . . 106.63 112.641 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.9 -42.66 80.81 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.086 0.469 . . . . 397.23000000000002 110.612 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 -68.2 -35.49 78.07 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.856 -0.611 . . . . 176.41 112.236 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.631 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -59.8 -34.64 73.3 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 111.453 0.168 . . . . 224.31999999999999 111.453 -179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -64.98 -41.16 95.67 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.062 0.458 . . . . 999.99000000000001 109.898 178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.22 -39.81 78.33 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.494 -0.776 . . . . 158.16999999999999 110.265 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -39.52 97.69 Favored Glycine 0 C--N 1.336 0.542 0 CA-C-N 115.421 -0.809 . . . . 65.709999999999994 112.535 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.18 92.67 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-O 120.596 0.236 . . . . 95.379999999999995 110.67 179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -64.78 -40.43 95.24 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.102 -0.499 . . . . 381.13999999999999 110.25 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.65 -43.24 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 115.639 -0.71 . . . . 182.12 110.589 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.72 -22.37 64.07 Favored Glycine 0 CA--C 1.52 0.394 0 CA-C-N 115.895 -0.593 . . . . 88.799999999999997 113.429 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 90.5 mmt-85 -80.08 -18.56 49.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.896 0.348 . . . . 999.99000000000001 111.191 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 29.1 mmt85 -108.47 111.98 24.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.9 0.381 . . . . 999.99000000000001 110.379 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 60.4 mt -124.66 126.17 71.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.844 -0.428 . . . . 308.67000000000002 109.844 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -123.35 32.23 5.71 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.971 -0.292 . . . . 388.05000000000001 111.633 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 77.7 mtm -70.0 -28.73 65.74 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.556 -0.293 . . . . 360.56999999999999 111.039 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.79 -37.96 80.57 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.016 -0.538 . . . . 184.22999999999999 110.777 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -59.83 -42.21 93.04 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.665 -0.698 . . . . 999.99000000000001 110.368 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.94 -46.78 84.53 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.821 -0.627 . . . . 374.13 111.12 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -60.12 -44.37 94.95 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.536 0.208 . . . . 999.99000000000001 110.799 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.21 -42.74 93.18 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.455 -0.339 . . . . 558.87 111.126 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.85 96.8 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.063 -0.517 . . . . 332.85000000000002 111.574 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 60.8 tp -61.97 -46.22 90.21 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.887 -0.597 . . . . 472.20999999999998 110.852 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -63.73 -39.31 93.98 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.307 -0.406 . . . . 821.44000000000005 111.352 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.73 -38.91 79.41 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.196 -0.456 . . . . 746.24000000000001 111.879 179.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -83.09 -11.65 57.8 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.601 -0.272 . . . . 999.99000000000001 111.385 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 55.9 t30 54.98 39.89 31.8 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.563 0.539 . . . . 675.44000000000005 111.615 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 66.2 ttp -107.72 124.0 49.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.337 -0.392 . . . . 999.99000000000001 110.874 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 75.3 mt -94.11 117.12 67.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.378 -0.374 . . . . 390.38 110.373 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -59.78 142.02 97.89 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.821 2.347 . . . . 243.11000000000001 112.421 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -84.79 119.49 25.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.816 0.341 . . . . 618.10000000000002 110.403 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -70.07 116.5 10.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 999.99000000000001 111.058 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.702 ' O ' ' HG2' ' A' ' 118' ' ' MET . 3.4 mm? -99.04 129.96 28.45 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.488 . . . . 415.25 111.243 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 115' ' ' LEU . 50.1 Cg_exo -58.5 -31.9 95.3 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.733 2.289 . . . . 529.14999999999998 112.565 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -61.22 -40.89 95.68 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.931 0.715 . . . . 516.88 112.931 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . 0.702 ' HG2' ' O ' ' A' ' 115' ' ' LEU . 24.8 ptt? -55.39 -22.46 19.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.551 0.575 . . . . 914.60000000000002 112.551 -178.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -61.13 -39.09 88.7 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.144 0.497 . . . . 675.30999999999995 110.337 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -67.75 -37.23 81.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.755 -0.657 . . . . 900.95000000000005 111.147 179.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 92.2 mt -60.34 -46.25 95.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 112.761 0.652 . . . . 300.73000000000002 112.761 -178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -80.46 -9.84 59.75 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 120.208 -0.597 . . . . 595.28999999999996 111.232 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 25.1 tpp180 -87.98 -32.77 18.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.822 0.344 . . . . 999.99000000000001 110.923 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.1 ptp -77.7 148.32 35.01 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.032 0.444 . . . . 385.68000000000001 111.855 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 125' ' ' ARG . 42.5 ttm105 -51.96 128.69 37.96 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-N 115.371 -0.831 . . . . 999.99000000000001 111.572 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -55.19 -35.32 90.69 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 123.096 2.531 . . . . 149.59999999999999 112.895 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.13 -24.14 67.76 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.119 -0.491 . . . . 147.02000000000001 112.117 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -91.73 -0.93 57.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.622 -0.263 . . . . 360.37 111.563 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.2 t -88.0 119.23 70.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-O 120.688 0.28 . . . . 187.93000000000001 110.829 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.17 156.98 58.52 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.826 2.351 . . . . 265.38999999999999 112.749 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.408 HG13 ' HG2' ' A' ' 59' ' ' GLN . 93.9 t -118.73 137.45 52.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.057 -0.52 . . . . 246.78 110.53 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -114.57 129.79 56.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.505 -0.316 . . . . 999.99000000000001 110.425 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -82.69 75.28 9.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.938 0.399 . . . . 495.41000000000003 110.91 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 78.5 mtm . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.25 -0.881 . . . . 761.34000000000003 110.995 179.767 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 71.4 mtt85 . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 120.818 0.342 . . . . 999.99000000000001 110.335 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.6 m -92.11 -2.01 56.85 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.081 0.4 . . . . 999.99000000000001 112.081 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -102.78 129.45 49.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.812 0.339 . . . . 999.99000000000001 110.866 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -111.0 15.43 21.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 999.99000000000001 111.209 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -107.62 -111.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.463 -0.335 . . . . 999.99000000000001 110.73 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.1 m -129.67 153.87 39.43 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 CA-C-O 120.751 0.31 . . . . 375.51999999999998 110.659 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -81.15 156.97 71.52 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.447 . . . . 999.99000000000001 110.829 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -59.78 139.76 90.04 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.639 2.226 . . . . 436.63 111.933 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -121.86 -51.26 2.03 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.868 0.322 . . . . 999.99000000000001 111.868 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -101.02 3.22 41.29 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.81 0.3 . . . . 999.99000000000001 111.81 -179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' A' ' 11' ' ' LEU . 1.8 mm? -57.97 113.62 1.97 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.826 0.346 . . . . 781.60000000000002 111.492 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -114.24 152.07 31.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 216.75 110.969 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.34 -41.72 97.51 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.218 -0.446 . . . . 902.89999999999998 110.557 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.56 -38.79 82.06 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.932 -0.576 . . . . 121.34999999999999 111.405 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 18.3 m-30 -63.08 -37.98 89.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 265.05000000000001 109.876 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.21 -44.07 96.35 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.855 -0.611 . . . . 524.44000000000005 110.271 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.89 -45.81 97.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.609 -0.723 . . . . 214.56 111.242 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.71 -39.19 90.63 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.058 -0.519 . . . . 61.909999999999997 111.164 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.406 HD21 ' HB3' ' A' ' 85' ' ' TYR . 76.1 mt -62.02 -42.37 99.09 Favored 'General case' 0 C--O 1.227 -0.128 0 CA-C-N 116.35 -0.386 . . . . 321.58999999999997 110.715 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.425 ' O ' HG12 ' A' ' 24' ' ' ILE . 31.7 mmmt -61.98 -39.81 93.45 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.383 -0.371 . . . . 491.97000000000003 111.353 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 76.4 t -64.0 -46.64 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.669 -0.241 . . . . 179.68000000000001 110.994 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 71.9 tp60 -68.41 -42.72 78.56 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.907 0.384 . . . . 483.12 111.034 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.444 HD13 ' SD ' ' A' ' 58' ' ' MET . 83.6 mt -63.8 -46.73 93.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 115.728 -0.669 . . . . 120.91 112.432 -179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 20' ' ' LYS . 30.1 mm -61.02 -45.98 97.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 121.044 -0.263 . . . . 324.41000000000003 111.058 -179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.51 92.28 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 111.768 0.285 . . . . 76.379999999999995 111.768 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.52 -45.25 90.78 Favored Glycine 0 C--N 1.335 0.521 0 C-N-CA 120.938 -0.649 . . . . 59.560000000000002 113.683 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.431 ' CD1' HG23 ' A' ' 23' ' ' ILE . 46.6 m-85 -73.2 -20.79 60.8 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.017 0.377 . . . . 169.43000000000001 112.017 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.491 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.0 t70 -75.9 -38.14 58.07 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.827 -0.17 . . . . 145.09 111.17 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.7 tpp85 -60.56 -45.82 92.49 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 109.833 -0.432 . . . . 779.76999999999998 109.833 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.427 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.47 -40.09 98.2 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.761 -0.654 . . . . 72.329999999999998 112.387 178.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.5 mt -63.33 -39.46 94.61 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.573 0.225 . . . . 213.66999999999999 111.122 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 28' ' ' ASP . 57.6 t -59.8 -40.09 81.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.137 -0.483 . . . . 275.81999999999999 111.76 -178.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.17 -41.6 93.17 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 111.653 0.242 . . . . 545.0 111.653 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.427 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 7.3 m-90 -80.74 -36.95 31.37 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.687 0.28 . . . . 999.99000000000001 111.49 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 92.8 mt -64.74 -38.37 90.75 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.536 0.569 . . . . 205.93000000000001 112.536 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -64.13 -18.82 64.8 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.449 0.537 . . . . 557.46000000000004 112.449 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 97.1 t -84.71 -42.92 17.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.741 0.305 . . . . 284.56999999999999 111.699 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -104.25 11.96 34.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.753 0.311 . . . . 350.44 111.555 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.18 -20.14 68.87 Favored Glycine 0 CA--C 1.517 0.195 0 CA-C-N 116.049 -0.523 . . . . 199.69999999999999 114.359 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.8 ttm-85 -61.31 -40.84 95.67 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.038 0.419 . . . . 999.99000000000001 111.662 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 57.6 p -113.4 9.99 18.25 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.911 0.338 . . . . 302.80000000000001 111.911 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.6 tp -71.75 123.35 22.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.986 0.422 . . . . 581.97000000000003 111.946 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.5 m -79.77 157.93 26.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.98 -0.555 . . . . 239.06999999999999 110.454 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 94.2 m -60.93 -44.36 97.34 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.803 0.335 . . . . 192.00999999999999 111.183 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.39 -31.75 52.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.263 -0.426 . . . . 278.44999999999999 112.068 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -65.92 -41.97 90.7 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.867 0.365 . . . . 316.42000000000002 110.282 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.493 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 65.7 tttp -62.86 -46.42 87.95 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.808 -0.633 . . . . 470.35000000000002 110.229 178.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.18 -40.72 98.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.395 -0.821 . . . . 369.77999999999997 111.252 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.37 95.71 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.169 -0.469 . . . . 66.790000000000006 111.626 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.25 -39.11 93.28 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.29 -0.414 . . . . 238.30000000000001 112.0 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.493 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 36.3 m-85 -63.5 -37.94 89.23 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.829 -0.434 . . . . 526.92999999999995 109.829 178.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -62.27 -47.14 85.64 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.622 -0.717 . . . . 162.88 111.341 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.25 -26.81 23.04 Favored 'Isoleucine or valine' 0 C--N 1.343 0.312 0 C-N-CA 120.5 -0.48 . . . . 139.00999999999999 111.366 -179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.12 -44.36 96.81 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.859 0.362 . . . . 198.61000000000001 110.307 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtm-85 -64.99 -38.64 91.62 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 115.875 -0.602 . . . . 999.99000000000001 110.975 179.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -60.24 -45.39 93.42 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.33 -0.395 . . . . 799.64999999999998 109.973 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 17.6 t80 -59.63 -47.7 84.55 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.893 -0.594 . . . . 151.58000000000001 110.437 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.444 ' SD ' HD13 ' A' ' 23' ' ' ILE . 18.6 tmm? -59.99 -46.18 90.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 168.43000000000001 111.263 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 55.5 mt-30 -62.82 -40.96 99.01 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 112.034 0.383 . . . . 530.55999999999995 112.034 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 75.9 p -69.91 -39.34 76.23 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.84 -0.344 . . . . 293.49000000000001 111.476 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -71.98 -42.82 66.03 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 120.901 0.381 . . . . 383.72000000000003 110.79 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.6 t-105 -62.59 -40.17 96.04 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.83 -0.623 . . . . 497.0 111.961 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.84 -40.81 80.95 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.096 0.406 . . . . 177.0 112.096 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 58.0 m-80 -63.66 -42.24 98.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.691 0.281 . . . . 478.75999999999999 111.03 179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.06 -39.96 68.68 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.401 -0.363 . . . . 727.09000000000003 111.344 179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.7 tpt -52.53 -43.09 64.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.81 -0.632 . . . . 664.46000000000004 112.16 -179.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -61.67 -43.54 98.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.675 -0.239 . . . . 447.74000000000001 111.281 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.22 -40.03 78.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.942 0.401 . . . . 999.99000000000001 110.855 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.566 HD13 HD13 ' A' ' 88' ' ' LEU . 96.9 mt -63.14 -44.97 99.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.759 -0.655 . . . . 398.94999999999999 110.64 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.03 -41.81 97.27 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.017 -0.538 . . . . 366.97000000000003 110.925 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -62.56 -43.14 99.55 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.616 -0.265 . . . . 709.00999999999999 110.873 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.41 -47.46 81.89 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.164 -0.471 . . . . 931.13999999999999 111.136 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.8 mt -63.41 -45.75 97.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.186 -0.461 . . . . 175.25999999999999 111.076 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.203 -0.453 . . . . 443.19 111.449 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.5 -40.46 97.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.375 -0.375 . . . . 366.44 111.716 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.8 mt -69.16 -40.99 77.84 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.909 0.385 . . . . 386.93000000000001 111.247 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.72 -8.89 78.19 Favored Glycine 0 C--N 1.333 0.39 0 C-N-CA 121.155 -0.545 . . . . 244.66999999999999 112.733 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -75.2 145.1 42.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.74 0.305 . . . . 999.99000000000001 111.354 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 34.8 p -83.88 120.54 75.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.441 -0.345 . . . . 263.29000000000002 110.67 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.98 146.52 37.32 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.498 2.132 . . . . 173.88999999999999 112.987 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 28.6 m -102.57 169.84 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.485 . . . . 201.66 111.158 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 69.1 t -61.64 -40.48 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.204 -0.453 . . . . 81.090000000000003 111.205 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.43 -39.07 94.39 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.152 -0.547 . . . . 106.63 112.94 -179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.77 -40.53 95.48 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.826 0.346 . . . . 397.23000000000002 110.527 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.406 ' HB3' HD21 ' A' ' 19' ' ' LEU . 48.9 m-85 -67.92 -40.09 83.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.085 -0.507 . . . . 176.41 111.563 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 72.3 p -68.26 -34.69 76.65 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 121.004 -0.278 . . . . 224.31999999999999 111.075 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -62.77 -45.2 93.79 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.958 0.408 . . . . 999.99000000000001 109.985 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 69' ' ' ILE . 86.2 mt -64.16 -41.33 97.19 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 115.702 -0.681 . . . . 158.16999999999999 110.785 179.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.95 -40.27 99.08 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.992 -0.549 . . . . 65.709999999999994 112.432 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.18 -39.46 92.78 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.671 0.272 . . . . 95.379999999999995 111.247 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.01 -39.95 90.7 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.099 0.476 . . . . 381.13999999999999 110.734 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.76 -40.05 86.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.545 -0.752 . . . . 182.12 110.943 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.413 ' HA2' ' CE1' ' A' ' 27' ' ' PHE . . . -64.76 -14.14 57.66 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.875 -0.602 . . . . 88.799999999999997 114.162 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -78.25 -22.35 48.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.178 0.489 . . . . 999.99000000000001 111.441 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -109.01 115.43 30.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.899 0.381 . . . . 999.99000000000001 110.842 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.0 pt -131.85 153.04 37.94 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 120.876 0.37 . . . . 308.67000000000002 111.225 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 47.8 p-10 -116.24 20.73 14.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 388.05000000000001 110.703 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 96.0 mmm -61.96 -39.36 91.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.556 . . . . 360.56999999999999 111.627 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.26 96.71 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.895 0.379 . . . . 184.22999999999999 110.634 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -69.08 -40.14 78.63 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.738 -0.665 . . . . 999.99000000000001 110.53 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -59.71 -49.08 79.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.005 -0.543 . . . . 374.13 110.73 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -60.52 -48.3 82.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.067 -0.515 . . . . 999.99000000000001 110.869 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -62.21 -45.91 91.24 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.139 -0.482 . . . . 558.87 111.501 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.9 -40.79 98.63 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.551 -0.295 . . . . 332.85000000000002 111.695 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.474 HD11 ' HD3' ' A' ' 112' ' ' PRO . 61.1 tp -61.35 -47.39 86.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.294 -0.412 . . . . 472.20999999999998 110.573 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -66.71 -39.03 87.87 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.197 -0.456 . . . . 821.44000000000005 111.017 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.05 -40.63 81.44 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.92 -0.582 . . . . 746.24000000000001 111.953 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -82.52 -11.38 58.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.626 -0.261 . . . . 999.99000000000001 111.466 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.8 t30 55.01 44.28 28.46 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.189 0.518 . . . . 675.44000000000005 111.699 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 26.5 mmt -117.45 128.74 55.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 999.99000000000001 110.534 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.6 mm -94.63 116.6 66.56 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.534 -0.303 . . . . 390.38 110.67 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.474 ' HD3' HD11 ' A' ' 105' ' ' LEU . 73.2 Cg_endo -73.53 154.86 50.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.467 2.112 . . . . 243.11000000000001 112.312 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -81.7 121.43 26.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.774 0.321 . . . . 618.10000000000002 110.231 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -69.26 138.38 53.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.041 -0.527 . . . . 999.99000000000001 110.846 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 83.4 mt -99.24 112.72 63.82 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 415.25 112.011 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -60.45 -27.58 85.13 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.119 2.546 . . . . 529.14999999999998 111.996 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -60.57 -26.43 66.93 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.119 -0.946 . . . . 516.88 111.556 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 30.8 mmm -57.18 -28.24 62.62 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 112.443 0.534 . . . . 914.60000000000002 112.443 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -60.2 -44.24 95.27 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 110.024 -0.361 . . . . 675.30999999999995 110.024 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -67.43 -39.19 85.44 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.064 -0.516 . . . . 900.95000000000005 110.821 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.51 -45.05 99.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 116.164 -0.471 . . . . 300.73000000000002 110.865 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -61.13 -40.11 92.54 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.97 -0.559 . . . . 595.28999999999996 111.288 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -67.37 -33.27 74.87 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.202 0.445 . . . . 999.99000000000001 112.202 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 99.4 mtp -76.76 129.74 36.72 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.301 0.482 . . . . 385.68000000000001 112.301 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -54.04 147.82 23.84 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 115.537 -0.756 . . . . 999.99000000000001 111.441 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -60.1 -28.2 86.51 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 122.758 2.306 . . . . 149.59999999999999 112.522 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.48 -31.32 72.04 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.168 -0.469 . . . . 147.02000000000001 111.291 178.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -91.21 -0.06 57.62 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.073 -0.512 . . . . 360.37 111.696 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 59.2 t -90.53 115.38 64.03 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 120.656 0.265 . . . . 187.93000000000001 110.636 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.9 159.46 48.09 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.786 2.324 . . . . 265.38999999999999 112.773 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 59.1 t -116.59 136.81 52.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 246.78 109.539 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -113.27 120.83 42.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.926 0.394 . . . . 999.99000000000001 111.358 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -84.17 163.37 19.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.825 -0.625 . . . . 495.41000000000003 110.23 178.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.2 mmt . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.282 -0.866 . . . . 761.34000000000003 110.685 -179.502 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.9 tpp180 . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.531 0.205 . . . . 999.99000000000001 110.771 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.1 t -150.01 119.03 6.69 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 121.253 -0.179 . . . . 999.99000000000001 110.554 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 44.6 m0 56.05 34.65 24.16 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.503 0.502 . . . . 999.99000000000001 112.219 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.4 m170 -99.15 5.07 46.98 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.724 0.297 . . . . 999.99000000000001 111.411 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -127.67 -90.35 0.52 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.436 -0.347 . . . . 999.99000000000001 110.782 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 66.6 t -124.75 126.95 72.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.525 -0.307 . . . . 375.51999999999998 110.7 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -82.27 124.95 77.88 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 999.99000000000001 110.363 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.06 141.16 43.3 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.439 2.093 . . . . 436.63 112.835 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -132.04 148.6 52.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.002 -0.545 . . . . 999.99000000000001 110.467 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 56.33 43.14 26.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.607 0.567 . . . . 999.99000000000001 112.052 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.52 137.02 49.5 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.268 -0.424 . . . . 781.60000000000002 111.251 179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -88.04 104.31 16.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.404 . . . . 216.75 110.316 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -63.33 -39.16 93.77 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.775 -0.648 . . . . 902.89999999999998 112.166 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.76 -41.31 90.72 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.738 0.304 . . . . 121.34999999999999 111.741 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -67.71 -33.91 75.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 265.05000000000001 109.932 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 96.5 mt-10 -64.98 -40.45 94.99 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.737 -0.665 . . . . 524.44000000000005 110.27 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.58 -46.44 96.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 115.955 -0.566 . . . . 214.56 111.037 179.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.45 92.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.927 -0.579 . . . . 61.909999999999997 110.322 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.2 tp -64.11 -39.27 93.67 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.409 -0.814 . . . . 321.58999999999997 110.898 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 16' ' ' GLU . 98.4 mttt -59.22 -37.08 76.63 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.907 -0.588 . . . . 491.97000000000003 111.671 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 70.7 t -62.51 -43.76 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.806 0.336 . . . . 179.68000000000001 110.461 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -68.56 -39.69 80.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.892 0.377 . . . . 483.12 110.554 178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 88.1 mt -62.78 -47.4 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.689 -0.687 . . . . 120.91 112.84 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 pt -63.33 -37.39 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 N-CA-C 112.577 0.584 . . . . 324.41000000000003 112.577 -178.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.06 -45.81 91.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.637 0.256 . . . . 76.379999999999995 111.441 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -70.43 -41.91 65.89 Favored Glycine 0 CA--C 1.521 0.407 0 C-N-CA 121.023 -0.608 . . . . 59.560000000000002 113.2 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -73.01 -19.02 61.28 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.731 0.641 . . . . 169.43000000000001 112.731 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -75.01 -36.49 61.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 121.072 -0.251 . . . . 145.09 111.045 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -63.65 -40.53 97.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.929 0.395 . . . . 779.76999999999998 110.191 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.65 -39.36 97.46 Favored Glycine 0 C--N 1.333 0.384 0 CA-C-N 115.701 -0.681 . . . . 72.329999999999998 112.177 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' SD ' ' A' ' 98' ' ' MET . 83.7 mt -62.63 -40.67 97.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.717 0.294 . . . . 213.66999999999999 110.608 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.7 t -61.38 -42.79 95.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.789 -0.641 . . . . 275.81999999999999 111.36 -179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 68.5 mttm -61.38 -41.51 97.23 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.532 -0.304 . . . . 545.0 111.418 -179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -70.62 -43.9 68.34 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.287 0.565 . . . . 999.99000000000001 110.211 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 97.2 mt -63.27 -38.97 93.23 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.341 -0.845 . . . . 205.93000000000001 113.163 -178.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 33' ' ' LYS . 16.2 ptm180 -63.9 -18.65 64.42 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.508 0.558 . . . . 557.46000000000004 112.508 -178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 95.8 t -84.92 -44.99 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 112.031 0.382 . . . . 284.56999999999999 112.031 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -103.28 9.57 38.01 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.773 0.321 . . . . 350.44 111.775 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.99 -21.29 63.45 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.559 0.584 . . . . 199.69999999999999 114.559 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.49 -41.19 96.89 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 117.187 0.494 . . . . 999.99000000000001 111.696 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 56.7 p -113.69 10.23 17.92 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.911 0.337 . . . . 302.80000000000001 111.911 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 46.8 tp -71.64 124.58 25.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.126 0.417 . . . . 581.97000000000003 112.126 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.2 m -78.98 158.67 27.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.024 -0.534 . . . . 239.06999999999999 110.305 178.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 90.6 m -60.91 -44.78 96.68 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.664 0.269 . . . . 192.00999999999999 111.575 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -69.08 -31.76 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 N-CA-C 112.075 0.398 . . . . 278.44999999999999 112.075 -179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -64.9 -40.15 94.64 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.536 0.208 . . . . 316.42000000000002 110.82 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' O ' ' HD1' ' A' ' 51' ' ' TYR . 29.3 ttpp -61.37 -45.86 92.61 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.26 -0.427 . . . . 470.35000000000002 110.43 179.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -65.22 -39.66 93.08 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.045 -0.525 . . . . 369.77999999999997 110.674 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.74 92.65 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.877 -0.602 . . . . 66.790000000000006 111.295 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.5 mt -63.42 -38.58 91.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.095 -0.502 . . . . 238.30000000000001 111.785 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.438 ' HD1' ' O ' ' A' ' 47' ' ' LYS . 23.3 m-85 -61.66 -38.96 89.69 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.505 -0.554 . . . . 526.92999999999995 109.505 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -65.29 -41.75 93.82 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.674 -0.694 . . . . 162.88 109.74 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.6 t -62.43 -40.4 87.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.041 -0.527 . . . . 139.00999999999999 110.339 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.2 t30 -58.86 -39.42 81.28 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.561 -0.745 . . . . 198.61000000000001 110.963 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.7 mmm-85 -61.77 -42.23 98.72 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.722 -0.217 . . . . 999.99000000000001 110.583 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.35 -40.8 96.58 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.06 0.457 . . . . 799.64999999999998 110.116 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -61.65 -48.18 82.04 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.608 -0.724 . . . . 151.58000000000001 110.93 178.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -60.52 -46.84 88.67 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.828 -0.624 . . . . 168.43000000000001 112.023 -178.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -65.65 -33.54 76.12 Favored 'General case' 0 N--CA 1.461 0.122 0 C-N-CA 120.733 -0.387 . . . . 530.55999999999995 111.145 -179.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 91.0 m -66.1 -45.99 79.22 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.194 0.521 . . . . 293.49000000000001 110.214 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 -64.29 -45.29 88.67 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.635 -0.711 . . . . 383.72000000000003 110.445 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 76.0 t-105 -62.73 -43.53 98.56 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.666 -0.697 . . . . 497.0 111.845 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.27 -38.99 78.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.125 0.417 . . . . 177.0 112.125 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -60.07 -49.75 76.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.843 0.354 . . . . 478.75999999999999 110.889 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.431 ' O ' HG12 ' A' ' 69' ' ' ILE . 54.4 m-85 -72.17 -37.76 69.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.328 -0.396 . . . . 727.09000000000003 111.658 179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -53.0 -46.21 68.22 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.433 0.458 . . . . 664.46000000000004 110.788 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 63.9 tp -62.44 -44.44 96.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.989 -0.551 . . . . 447.74000000000001 111.276 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 49.3 m0 -66.91 -40.69 87.76 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.582 0.586 . . . . 999.99000000000001 112.582 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 65' ' ' TYR . 47.3 pt -79.21 -25.51 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 N-CA-C 112.203 0.446 . . . . 398.94999999999999 112.203 -179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -60.52 -41.89 95.32 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.529 0.204 . . . . 366.97000000000003 110.813 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.6 -47.15 86.76 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.335 -0.393 . . . . 709.00999999999999 110.618 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -63.38 -46.75 85.02 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.928 -0.578 . . . . 931.13999999999999 111.286 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 95.0 mt -63.15 -44.99 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.146 -0.479 . . . . 175.25999999999999 111.162 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -61.24 -43.85 98.21 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.314 -0.403 . . . . 443.19 111.269 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.02 -40.35 97.47 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.517 -0.311 . . . . 366.44 111.402 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.13 -39.57 82.69 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.295 -0.411 . . . . 386.93000000000001 111.253 179.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.65 -0.04 89.22 Favored Glycine 0 C--N 1.332 0.317 0 CA-C-N 116.0 -0.546 . . . . 244.66999999999999 112.508 -179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 17.2 mmp_? -75.16 149.7 38.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.907 0.384 . . . . 999.99000000000001 111.227 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.4 p -106.83 101.07 35.11 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.271 -0.422 . . . . 263.29000000000002 110.807 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 78' ' ' ARG . 43.1 Cg_exo -59.88 142.52 98.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 123.132 2.555 . . . . 173.88999999999999 112.931 -179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.428 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 15.7 m -100.26 -176.36 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.988 -0.551 . . . . 201.66 110.971 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 68.7 t -59.64 -43.46 91.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.39 -0.368 . . . . 81.090000000000003 111.082 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.11 -39.55 95.96 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.52 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -62.16 -41.28 98.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.896 0.379 . . . . 397.23000000000002 110.72 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.428 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 47.6 m-85 -68.38 -39.95 81.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.968 -0.56 . . . . 176.41 111.416 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.4 p -67.34 -36.0 80.53 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 111.633 0.234 . . . . 224.31999999999999 111.633 -179.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -62.61 -47.16 84.99 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.215 0.531 . . . . 999.99000000000001 110.095 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 tp -67.99 -42.09 81.29 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.575 -0.739 . . . . 158.16999999999999 110.514 179.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.32 -39.39 97.16 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.763 -0.653 . . . . 65.709999999999994 113.042 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -60.77 -40.76 93.73 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.756 0.312 . . . . 95.379999999999995 110.869 179.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -64.4 -39.44 93.86 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.097 -0.501 . . . . 381.13999999999999 110.352 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.4 mm -63.9 -42.09 94.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.628 -0.715 . . . . 182.12 110.758 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -71.17 -9.35 67.11 Favored Glycine 0 CA--C 1.521 0.466 0 CA-C-N 115.842 -0.617 . . . . 88.799999999999997 113.995 -179.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 28.3 mmm180 -77.72 -25.96 49.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 117.314 0.557 . . . . 999.99000000000001 111.331 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -108.53 112.15 24.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.891 0.376 . . . . 999.99000000000001 110.681 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 79.0 mt -125.68 125.82 69.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.252 -0.431 . . . . 308.67000000000002 110.591 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -137.44 65.67 1.48 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.883 0.373 . . . . 388.05000000000001 110.581 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.557 ' SD ' HD23 ' A' ' 31' ' ' LEU . 28.3 ptm -72.38 -21.12 61.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.987 -0.552 . . . . 360.56999999999999 110.755 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -61.29 -39.27 89.82 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.886 -0.597 . . . . 184.22999999999999 110.681 179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.22 -48.35 82.1 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.796 -0.638 . . . . 999.99000000000001 111.143 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -62.81 -44.06 97.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.354 -0.384 . . . . 374.13 110.301 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -60.67 -47.67 85.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 115.911 -0.586 . . . . 999.99000000000001 110.539 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -61.46 -41.68 97.59 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.762 -0.654 . . . . 558.87 111.062 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.07 98.08 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.387 -0.37 . . . . 332.85000000000002 111.209 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.95 -41.09 97.69 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.46 -0.336 . . . . 472.20999999999998 110.598 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -63.0 -44.53 95.77 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.807 -0.633 . . . . 821.44000000000005 111.158 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -58.78 -39.79 82.11 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.075 -0.512 . . . . 746.24000000000001 112.155 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -91.37 0.19 57.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.562 -0.29 . . . . 999.99000000000001 111.697 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 57.5 36.2 26.68 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.022 0.439 . . . . 675.44000000000005 111.21 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 16.7 mmt -100.19 79.39 2.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.167 0.508 . . . . 999.99000000000001 111.088 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 71.6 mt -93.65 120.67 65.96 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.896 -0.593 . . . . 390.38 110.17 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.91 149.93 66.63 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.366 2.044 . . . . 243.11000000000001 112.504 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -80.11 129.67 34.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.359 -0.382 . . . . 618.10000000000002 110.63 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -69.87 86.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.97 -0.559 . . . . 999.99000000000001 111.199 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.97 149.67 35.96 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 415.25 111.297 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.18 -25.22 65.27 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.737 2.292 . . . . 529.14999999999998 112.322 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -60.63 -45.14 95.17 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.04 -0.527 . . . . 516.88 111.338 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 96.8 mtp -59.99 -40.68 90.01 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.249 -0.432 . . . . 914.60000000000002 109.885 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -62.28 -40.43 96.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.777 -0.647 . . . . 675.30999999999995 110.374 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -62.97 -42.13 99.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.859 -0.61 . . . . 900.95000000000005 111.179 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.9 mm -61.29 -44.49 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.68 0.276 . . . . 300.73000000000002 110.449 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -61.25 -41.81 97.55 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.059 -0.518 . . . . 595.28999999999996 111.346 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -65.63 -33.88 76.93 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.346 -0.388 . . . . 999.99000000000001 111.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 98.8 mtp -72.57 140.68 48.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.879 0.371 . . . . 385.68000000000001 111.714 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.409 ' O ' HG23 ' A' ' 129' ' ' VAL . 91.3 mtm180 -52.38 141.3 33.13 Favored Pre-proline 0 C--O 1.234 0.281 0 CA-C-N 115.627 -0.715 . . . . 999.99000000000001 111.237 178.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -60.78 -25.73 81.67 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.677 2.251 . . . . 149.59999999999999 112.548 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.16 80.57 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.029 -0.532 . . . . 147.02000000000001 111.618 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.65 -2.54 57.85 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.339 -0.391 . . . . 360.37 111.934 -178.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 125' ' ' ARG . 60.9 t -93.18 116.1 65.99 Favored Pre-proline 0 C--N 1.329 -0.306 0 N-CA-C 110.243 -0.28 . . . . 187.93000000000001 110.243 179.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.21 151.03 72.22 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.44 2.094 . . . . 265.38999999999999 112.752 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.1 t -109.06 137.43 41.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.913 -0.585 . . . . 246.78 110.134 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -118.1 141.93 47.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.829 0.347 . . . . 999.99000000000001 110.733 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -83.39 158.83 21.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.062 -0.517 . . . . 495.41000000000003 110.81 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 96.2 mmm . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.348 -0.834 . . . . 761.34000000000003 111.139 -179.12 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 . . . . . 0 N--CA 1.469 0.478 0 CA-C-O 121.374 0.607 . . . . 999.99000000000001 112.603 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.7 p -153.06 164.35 38.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.247 -0.888 . . . . 999.99000000000001 109.361 179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 7.5 t-105 -115.96 -89.88 0.56 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 120.418 -0.513 . . . . 999.99000000000001 111.643 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -165.15 167.74 17.85 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.454 0.168 . . . . 999.99000000000001 110.968 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 70.35 -94.88 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.528 0 O-C-N 123.922 0.764 . . . . 999.99000000000001 111.967 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 63.7 t -115.46 120.64 65.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.919 0.39 . . . . 375.51999999999998 111.089 -179.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -91.52 119.98 68.38 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 999.99000000000001 110.562 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.44 139.38 34.48 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.295 1.996 . . . . 436.63 112.392 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -98.22 -11.33 22.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.963 0.411 . . . . 999.99000000000001 111.292 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -108.85 12.46 25.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.241 -0.436 . . . . 999.99000000000001 111.351 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 58.0 tp -56.81 114.49 2.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.017 0.437 . . . . 781.60000000000002 111.602 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -114.91 126.77 55.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.916 -0.584 . . . . 216.75 110.037 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.54 -39.49 91.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.769 0.319 . . . . 902.89999999999998 110.841 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.77 87.87 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.242 -0.435 . . . . 121.34999999999999 111.412 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -68.23 -32.48 72.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.009 -0.541 . . . . 265.05000000000001 110.108 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -63.08 -41.61 99.46 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.738 -0.665 . . . . 524.44000000000005 109.961 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.12 -45.8 97.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 115.803 -0.635 . . . . 214.56 111.033 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.16 -40.87 97.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.232 -0.44 . . . . 61.909999999999997 110.626 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.77 -43.01 97.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.823 -0.626 . . . . 321.58999999999997 110.312 178.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -59.72 -44.21 93.83 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.391 -0.822 . . . . 491.97000000000003 111.498 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.66 -42.82 97.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.212 -0.449 . . . . 179.68000000000001 111.69 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -63.9 -41.13 97.78 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.738 0.304 . . . . 483.12 111.177 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.76 -43.97 93.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.263 -0.426 . . . . 120.91 110.582 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 90.2 mt -61.59 -42.87 95.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 115.972 -0.558 . . . . 324.41000000000003 111.325 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.36 -44.49 95.52 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 111.743 0.275 . . . . 76.379999999999995 111.743 -179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.98 -41.28 97.4 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 120.801 -0.714 . . . . 59.560000000000002 112.493 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -73.18 -19.6 61.07 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.726 0.41 . . . . 169.43000000000001 111.504 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -75.64 -34.67 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.315 . . . . 145.09 111.046 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.75 -44.23 96.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.998 0.428 . . . . 779.76999999999998 109.907 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.04 -37.59 94.14 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.533 -0.758 . . . . 72.329999999999998 112.521 178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.7 mp -68.83 -41.27 78.78 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.71 0.291 . . . . 213.66999999999999 110.403 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 64.8 t -61.9 -44.9 99.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 CA-C-N 116.018 -0.537 . . . . 275.81999999999999 110.779 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 -40.14 95.07 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 120.756 0.312 . . . . 545.0 110.944 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.6 t90 -64.96 -42.0 94.99 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.315 -0.624 . . . . 999.99000000000001 109.315 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' O ' ' HA3' ' A' ' 39' ' ' GLY . 83.6 mt -62.67 -36.68 83.65 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.332 -0.849 . . . . 205.93000000000001 111.293 179.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -62.13 -37.72 86.23 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.585 0.217 . . . . 557.46000000000004 111.585 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 77.2 t -87.01 -50.59 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 N-CA-C 113.616 0.969 . . . . 284.56999999999999 113.616 -178.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -99.77 -1.49 37.54 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.083 0.771 . . . . 350.44 113.083 -177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 35' ' ' LEU . . . -73.51 -11.87 80.19 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 121.233 -0.508 . . . . 199.69999999999999 114.05 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.54 -41.17 96.95 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.91 0.355 . . . . 999.99000000000001 111.533 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 61.7 p -113.29 5.44 16.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.875 0.369 . . . . 302.80000000000001 111.694 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.4 tp -71.85 133.38 45.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.054 -0.521 . . . . 581.97000000000003 111.3 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 69.9 m -75.89 161.52 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.039 -0.528 . . . . 239.06999999999999 111.266 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.0 m -60.1 -44.54 94.76 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.998 -0.547 . . . . 192.00999999999999 111.913 -179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.48 -30.4 47.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.558 0.218 . . . . 278.44999999999999 111.352 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -67.04 -38.12 85.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.47 -0.332 . . . . 316.42000000000002 110.344 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -62.7 -40.41 97.04 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.074 0.464 . . . . 470.35000000000002 110.242 178.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -69.48 -33.01 72.26 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.627 -0.715 . . . . 369.77999999999997 110.784 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -59.67 -36.33 76.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.833 -0.621 . . . . 66.790000000000006 111.639 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.0 mt -60.49 -39.18 86.74 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.832 0.308 . . . . 238.30000000000001 111.832 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -63.55 -39.04 93.38 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.916 -0.402 . . . . 526.92999999999995 109.916 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -70.11 -40.72 74.72 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.758 -0.655 . . . . 162.88 110.449 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.6 t -63.59 -40.49 89.25 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 N-CA-C 109.655 -0.498 . . . . 139.00999999999999 109.655 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -59.34 -39.82 84.41 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.455 -0.793 . . . . 198.61000000000001 110.52 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 ttt-85 -60.69 -47.63 85.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.49 -0.323 . . . . 999.99000000000001 110.625 179.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -64.67 -41.26 96.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.139 0.495 . . . . 799.64999999999998 110.552 178.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -61.89 -47.35 85.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.46 -0.791 . . . . 151.58000000000001 110.905 179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.5 ttt -59.81 -48.21 82.62 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.429 -0.805 . . . . 168.43000000000001 112.82 -179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -66.04 -31.3 72.1 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.149 0.425 . . . . 530.55999999999995 112.149 -178.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.6 m -64.0 -49.72 71.33 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.882 0.372 . . . . 293.49000000000001 110.962 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.5 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 76.1 m-70 -72.56 -36.91 68.34 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.235 -0.439 . . . . 383.72000000000003 111.636 179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -60.13 -45.32 93.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.939 -0.573 . . . . 497.0 111.088 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -42.76 90.85 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.884 0.327 . . . . 177.0 111.884 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -64.44 -42.22 96.11 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.751 0.31 . . . . 478.75999999999999 111.175 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.5 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 38.5 m-85 -70.34 -37.48 74.66 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.245 -0.434 . . . . 727.09000000000003 111.371 179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 64.0 ttp -52.29 -46.12 65.79 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.086 -0.506 . . . . 664.46000000000004 111.722 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 91.4 mt -62.02 -41.49 98.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.462 -0.335 . . . . 447.74000000000001 111.056 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 48.1 m0 -67.72 -41.59 83.24 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.067 0.46 . . . . 999.99000000000001 110.666 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.8 mt -63.46 -45.63 97.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 115.637 -0.71 . . . . 398.94999999999999 111.223 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -61.86 -40.88 96.89 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.312 -0.404 . . . . 366.97000000000003 111.571 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -63.77 -42.29 97.82 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.699 0.285 . . . . 709.00999999999999 110.747 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -63.46 -46.16 87.5 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.08 -0.509 . . . . 931.13999999999999 111.098 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.64 -46.5 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 CA-C-N 116.196 -0.456 . . . . 175.25999999999999 111.111 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.14 -45.3 92.6 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.379 -0.373 . . . . 443.19 111.667 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.56 97.47 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.114 0.413 . . . . 366.44 112.114 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.7 mp -76.08 -44.36 39.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.865 0.364 . . . . 386.93000000000001 111.334 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.46 -10.82 73.27 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 121.207 -0.521 . . . . 244.66999999999999 113.132 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 16.9 ptm180 -75.34 155.27 36.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.951 0.405 . . . . 999.99000000000001 111.571 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.9 t -93.38 116.95 67.22 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-N 116.158 -0.473 . . . . 263.29000000000002 110.374 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.27 141.9 40.24 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.322 2.015 . . . . 173.88999999999999 113.178 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.45 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 17.9 m -102.45 -176.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.713 -0.676 . . . . 201.66 110.976 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 75.3 t -62.68 -41.03 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.904 0.383 . . . . 81.090000000000003 110.112 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.602 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.11 -38.73 94.81 Favored Glycine 0 C--N 1.333 0.414 0 CA-C-N 115.795 -0.638 . . . . 106.63 112.39 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -62.02 -40.98 97.53 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.038 0.447 . . . . 397.23000000000002 110.31 179.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.45 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 48.5 m-85 -69.18 -38.18 78.54 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.809 -0.632 . . . . 176.41 111.451 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.602 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.7 OUTLIER -64.47 -36.12 83.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 121.074 -0.25 . . . . 224.31999999999999 110.812 -179.736 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.77 -41.25 92.28 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.027 0.441 . . . . 999.99000000000001 110.292 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.5 mt -66.3 -41.34 89.87 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.733 -0.667 . . . . 158.16999999999999 110.388 178.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.24 -40.07 98.62 Favored Glycine 0 C--N 1.334 0.463 0 CA-C-N 115.645 -0.707 . . . . 65.709999999999994 112.417 179.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 94' ' ' ARG . . . -61.45 -40.56 94.92 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.484 0.183 . . . . 95.379999999999995 111.023 179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.13 -40.89 97.15 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 121.031 0.443 . . . . 381.13999999999999 110.659 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.02 -41.5 92.21 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.75 -0.659 . . . . 182.12 110.658 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -69.29 -10.04 61.96 Favored Glycine 0 CA--C 1.523 0.589 0 CA-C-N 115.677 -0.692 . . . . 88.799999999999997 114.093 -178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 90' ' ' ALA . 29.0 mmt85 -78.05 -22.25 49.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.404 0.602 . . . . 999.99000000000001 111.299 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.1 ttt85 -108.42 112.81 25.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.675 0.274 . . . . 999.99000000000001 110.314 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.9 mt -126.28 113.54 34.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 110.108 -0.33 . . . . 308.67000000000002 110.108 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -111.62 30.1 7.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.334 -0.394 . . . . 388.05000000000001 112.014 -179.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -61.53 -41.33 97.18 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 111.666 0.247 . . . . 360.56999999999999 111.666 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -62.92 -39.36 94.34 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.168 0.509 . . . . 184.22999999999999 110.989 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -65.31 -35.76 81.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.543 -0.753 . . . . 999.99000000000001 111.764 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -58.52 -49.37 77.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.666 0.27 . . . . 374.13 110.987 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -66.09 -38.2 87.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.28 -0.418 . . . . 999.99000000000001 111.499 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -61.37 -41.12 96.57 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.743 0.306 . . . . 558.87 110.349 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.07 -41.32 97.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.114 -0.494 . . . . 332.85000000000002 111.132 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.97 -40.9 83.09 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.009 -0.541 . . . . 472.20999999999998 111.236 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.18 -39.39 94.52 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.485 -0.325 . . . . 821.44000000000005 110.791 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -58.18 -41.45 83.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.095 -0.502 . . . . 746.24000000000001 111.322 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -91.46 1.41 57.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 999.99000000000001 111.468 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 56.7 t30 58.66 42.21 20.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.058 -0.519 . . . . 675.44000000000005 111.512 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 97.7 mmm -102.57 101.82 12.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 999.99000000000001 110.795 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 50.4 mm -94.13 119.81 66.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 390.38 110.794 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -72.45 153.26 55.34 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.606 2.204 . . . . 243.11000000000001 112.434 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -83.91 127.37 33.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.443 -0.344 . . . . 618.10000000000002 110.508 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -69.68 122.73 19.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.06 -0.518 . . . . 999.99000000000001 111.122 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 81.9 mt -99.69 117.12 64.17 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 415.25 111.589 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.14 -24.0 38.94 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.423 2.082 . . . . 529.14999999999998 112.093 179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -65.48 -25.25 67.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.553 -0.749 . . . . 516.88 111.275 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.5 -32.36 49.96 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.018 -0.537 . . . . 914.60000000000002 111.953 -179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.48 -40.12 90.14 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.821 0.343 . . . . 675.30999999999995 110.799 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.75 -38.48 89.21 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.94 -0.573 . . . . 900.95000000000005 110.872 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.6 mm -61.17 -44.95 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.28 0 CA-C-N 116.126 -0.488 . . . . 300.73000000000002 110.9 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -60.87 -38.4 85.48 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.415 -0.357 . . . . 595.28999999999996 111.304 179.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -65.48 -33.07 75.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.28 -0.418 . . . . 999.99000000000001 111.154 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 89.7 mmm -70.02 133.58 47.37 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.998 -0.547 . . . . 385.68000000000001 111.605 -179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.478 ' O ' HG23 ' A' ' 129' ' ' VAL . 6.9 mmp_? -53.34 138.41 48.71 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.972 -0.558 . . . . 999.99000000000001 111.163 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.84 -38.99 85.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.91 2.406 . . . . 149.59999999999999 113.123 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -65.28 -26.54 68.13 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.39 -0.368 . . . . 147.02000000000001 111.711 179.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -91.68 -3.47 56.25 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.433 -0.349 . . . . 360.37 111.799 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 125' ' ' ARG . 59.7 t -91.99 114.99 63.8 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.662 0.268 . . . . 187.93000000000001 110.543 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.24 147.89 60.77 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.279 1.986 . . . . 265.38999999999999 112.344 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 28.8 m -128.89 153.03 37.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.133 -0.485 . . . . 246.78 110.323 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -128.39 137.28 51.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 999.99000000000001 110.979 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -85.21 175.65 8.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.996 -0.547 . . . . 495.41000000000003 109.907 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 98.4 mtp . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.3 -0.857 . . . . 761.34000000000003 110.871 -179.228 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 . . . . . 0 N--CA 1.472 0.667 0 CA-C-O 120.883 0.373 . . . . 999.99000000000001 111.634 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.2 p -115.44 4.02 14.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.479 -0.328 . . . . 999.99000000000001 111.209 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 3.3 m95 60.92 22.53 12.68 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.018 -0.537 . . . . 999.99000000000001 111.862 -179.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 67.6 m80 58.07 -160.65 0.25 Allowed 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.946 0.498 . . . . 999.99000000000001 111.585 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -110.48 7.16 22.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.598 0.237 . . . . 999.99000000000001 111.399 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 57.4 t -119.09 120.88 65.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.821 0.343 . . . . 375.51999999999998 111.032 -179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -87.78 154.62 53.1 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 999.99000000000001 110.758 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.05 152.41 72.96 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.544 2.163 . . . . 436.63 112.298 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -82.12 55.61 2.88 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.168 0.433 . . . . 999.99000000000001 112.168 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 49.53 64.31 1.81 Allowed 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.43 0.456 . . . . 999.99000000000001 111.939 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.9 mt -55.51 132.38 48.4 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.08 0.467 . . . . 781.60000000000002 111.482 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -73.19 132.53 43.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.688 -0.687 . . . . 216.75 111.372 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -61.07 -41.94 97.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.058 -0.519 . . . . 902.89999999999998 111.044 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 17' ' ' VAL . . . -59.53 -39.16 83.02 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.976 0.417 . . . . 121.34999999999999 111.375 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.436 ' CD1' ' HB ' ' A' ' 82' ' ' VAL . 11.9 m-30 -68.45 -34.02 75.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.133 -0.485 . . . . 265.05000000000001 109.968 179.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -65.39 -40.6 93.66 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.615 -0.721 . . . . 524.44000000000005 111.761 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.625 HG21 ' HA ' ' A' ' 127' ' ' ALA . 9.8 p -69.79 -36.57 70.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 C-N-CA 120.777 -0.369 . . . . 214.56 111.378 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB3' HG21 ' A' ' 82' ' ' VAL . . . -63.78 -42.05 97.82 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-O 121.102 0.477 . . . . 61.909999999999997 110.477 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.89 -40.86 78.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.603 -0.726 . . . . 321.58999999999997 111.01 178.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 24' ' ' ILE . 40.2 ttpt -59.63 -45.17 92.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.726 -0.67 . . . . 491.97000000000003 112.559 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.81 -33.14 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 120.861 -0.336 . . . . 179.68000000000001 111.346 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.586 HE22 HG22 ' A' ' 86' ' ' THR . 75.1 mt-30 -66.94 -41.52 86.83 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.14 0.495 . . . . 483.12 110.22 179.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -67.05 -42.49 88.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 CA-C-N 115.431 -0.804 . . . . 120.91 110.427 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 20' ' ' LYS . 33.0 mm -60.57 -44.12 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 115.754 -0.657 . . . . 324.41000000000003 111.268 -179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -44.34 97.34 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.53 0.205 . . . . 76.379999999999995 111.353 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.37 -41.4 96.54 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 121.005 -0.617 . . . . 59.560000000000002 112.675 179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 9.1 m-30 -71.92 -25.55 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.754 0.311 . . . . 169.43000000000001 111.335 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.481 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.1 t0 -76.91 -36.25 56.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 145.09 110.874 -179.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -60.38 -46.59 89.43 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.845 -0.428 . . . . 779.76999999999998 109.845 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.97 -39.27 96.34 Favored Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.776 -0.647 . . . . 72.329999999999998 112.038 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 60.8 tp -61.64 -40.48 95.06 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 122.659 0.384 . . . . 213.66999999999999 111.379 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 28' ' ' ASP . 58.8 t -59.51 -44.26 92.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.762 -0.199 . . . . 275.81999999999999 110.946 -179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -62.4 -40.78 97.61 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.973 0.416 . . . . 545.0 110.528 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.593 ' HZ3' HD11 ' A' ' 42' ' ' LEU . 72.8 t90 -65.86 -41.66 91.36 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.913 -0.585 . . . . 999.99000000000001 109.961 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.424 ' HA ' ' HA3' ' A' ' 39' ' ' GLY . 87.8 mt -61.25 -36.84 81.08 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.64 -0.709 . . . . 205.93000000000001 111.468 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.72 -37.77 85.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.551 -0.295 . . . . 557.46000000000004 111.296 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.2 t -87.88 -51.16 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 113.53 0.937 . . . . 284.56999999999999 113.53 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -109.95 -22.8 11.67 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.174 0.805 . . . . 350.44 113.174 -177.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 35' ' ' LEU . . . -62.38 -21.39 62.18 Favored Glycine 0 N--CA 1.461 0.335 0 C-N-CA 121.145 -0.55 . . . . 199.69999999999999 113.828 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -62.84 -18.18 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.079 0.4 . . . . 999.99000000000001 112.079 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 67.0 p -102.81 -6.14 22.88 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 112.484 0.549 . . . . 302.80000000000001 112.484 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.593 HD11 ' HZ3' ' A' ' 34' ' ' TRP . 95.5 mt -73.42 142.77 46.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.035 0.445 . . . . 581.97000000000003 111.719 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 67.3 m -77.6 161.45 27.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.725 -0.67 . . . . 239.06999999999999 110.67 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -41.27 93.26 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.373 -0.376 . . . . 192.00999999999999 110.882 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.805 HG13 ' HB2' ' A' ' 114' ' ' TYR . 58.3 t -65.55 -42.74 93.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.157 -0.474 . . . . 278.44999999999999 110.721 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.665 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 96.5 mt-30 -63.07 -41.14 99.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.007 -0.542 . . . . 316.42000000000002 111.219 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -61.51 -46.69 88.92 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.262 -0.426 . . . . 470.35000000000002 111.353 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.73 -40.17 91.89 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.85 0.357 . . . . 369.77999999999997 111.383 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.27 -25.27 68.24 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.046 -0.525 . . . . 66.790000000000006 112.214 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 94.0 mt -64.08 -24.37 67.67 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.01 0.744 . . . . 238.30000000000001 113.01 -178.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 -60.57 -40.71 92.65 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 526.92999999999995 110.338 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -70.65 -37.17 73.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.24 -0.436 . . . . 162.88 110.409 178.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.63 -42.89 97.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.685 -0.689 . . . . 139.00999999999999 110.529 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -60.66 -40.13 90.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.94 -0.573 . . . . 198.61000000000001 111.173 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -60.87 -46.52 90.29 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.747 0.308 . . . . 999.99000000000001 110.414 179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -64.42 -38.74 92.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 799.64999999999998 110.706 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -59.93 -49.01 79.37 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.634 -0.712 . . . . 151.58000000000001 111.685 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 28.0 ptm -67.63 -37.16 82.07 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 121.065 -0.254 . . . . 168.43000000000001 111.483 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.0 mm-40 -65.61 -38.0 88.21 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 111.849 0.314 . . . . 530.55999999999995 111.849 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -60.15 -48.17 82.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.72 0.295 . . . . 293.49000000000001 111.006 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -71.34 -40.44 70.69 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.794 0.33 . . . . 383.72000000000003 111.22 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.9 t-105 -62.6 -45.7 91.68 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 112.418 0.525 . . . . 497.0 112.418 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.35 -41.25 84.28 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 112.383 0.512 . . . . 177.0 112.383 -178.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -62.02 -48.7 79.1 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.868 0.366 . . . . 478.75999999999999 111.155 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -72.15 -37.39 69.42 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.171 -0.468 . . . . 727.09000000000003 112.193 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 67.2 ttp -52.73 -46.79 67.57 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.396 -0.365 . . . . 664.46000000000004 111.94 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 67' ' ' LEU . 3.1 mm? -63.06 -44.14 96.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.82 -0.173 . . . . 447.74000000000001 111.15 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 77.3 t-105 -63.35 -47.09 83.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.983 0.42 . . . . 999.99000000000001 110.628 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 97.1 mt -63.34 -42.91 98.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 115.694 -0.685 . . . . 398.94999999999999 110.979 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -59.98 -42.06 93.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.232 -0.44 . . . . 366.97000000000003 111.428 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.59 -41.39 98.92 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.938 -0.305 . . . . 709.00999999999999 110.532 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.97 -45.45 92.38 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.043 -0.526 . . . . 931.13999999999999 110.254 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.45 -44.56 99.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 115.667 -0.697 . . . . 175.25999999999999 110.706 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -61.1 -44.57 97.16 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.111 -0.495 . . . . 443.19 111.138 179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.4 97.25 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.426 -0.352 . . . . 366.44 111.409 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.73 -39.65 80.27 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.293 -0.412 . . . . 386.93000000000001 111.291 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.43 77.46 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.178 -0.534 . . . . 244.66999999999999 112.278 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -74.95 152.61 38.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 999.99000000000001 111.442 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 20.5 p -117.95 94.48 46.43 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.371 -0.377 . . . . 263.29000000000002 110.476 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -72.12 150.27 53.62 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.762 2.308 . . . . 173.88999999999999 113.331 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 19.6 m -101.47 173.08 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.703 -0.68 . . . . 201.66 110.536 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 18' ' ' ALA . 9.0 p -56.33 -26.75 22.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.631 -0.258 . . . . 81.090000000000003 111.643 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.26 -38.66 96.04 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 121.11 -0.567 . . . . 106.63 112.012 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -73.62 -29.07 62.14 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.037 0.446 . . . . 397.23000000000002 110.698 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -69.16 -24.82 64.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.637 -0.71 . . . . 176.41 112.217 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.586 HG22 HE22 ' A' ' 22' ' ' GLN . 70.2 p -59.29 -35.83 74.48 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.553 0.216 . . . . 224.31999999999999 111.127 -179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -62.66 -44.9 95.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 121.034 0.445 . . . . 999.99000000000001 110.052 178.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -65.44 -41.04 93.9 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.705 -0.679 . . . . 158.16999999999999 110.492 179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.17 98.83 Favored Glycine 0 C--N 1.334 0.469 0 CA-C-N 115.598 -0.728 . . . . 65.709999999999994 112.652 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.29 -40.14 93.03 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.766 0.317 . . . . 95.379999999999995 111.098 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -65.22 -41.19 94.66 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-N 116.173 -0.467 . . . . 381.13999999999999 110.205 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.52 -42.77 96.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 182.12 110.691 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.62 -36.89 92.51 Favored Glycine 0 CA--C 1.52 0.382 0 CA-C-N 115.785 -0.643 . . . . 88.799999999999997 113.445 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 29.0 mmt85 -79.67 -10.87 59.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.196 0.443 . . . . 999.99000000000001 112.196 -179.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 84.5 mtp180 -108.37 112.47 24.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.814 0.34 . . . . 999.99000000000001 111.03 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 45.1 pt -131.85 152.09 36.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.488 -0.324 . . . . 308.67000000000002 111.154 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -155.2 38.67 0.4 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.2 0.524 . . . . 388.05000000000001 109.791 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 24.7 ptp -74.77 -16.19 60.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.665 -0.698 . . . . 360.56999999999999 112.356 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.31 -43.15 96.62 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.763 0.316 . . . . 184.22999999999999 111.356 -179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -71.15 -35.19 71.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.355 -0.384 . . . . 999.99000000000001 110.971 178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -60.74 -46.68 89.5 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.09 -0.504 . . . . 374.13 110.624 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 45.1 m-85 -63.45 -40.94 98.47 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.623 -0.262 . . . . 999.99000000000001 110.975 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -63.52 -40.76 97.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.21 -0.45 . . . . 558.87 110.668 179.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.32 -41.32 98.91 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.945 -0.57 . . . . 332.85000000000002 111.25 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -42.7 99.29 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.253 -0.431 . . . . 472.20999999999998 110.786 179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.3 ttpp -64.0 -42.33 97.21 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 116.252 -0.431 . . . . 821.44000000000005 111.082 178.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -57.7 -42.65 84.14 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.894 -0.594 . . . . 746.24000000000001 111.791 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -89.41 -3.24 58.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.347 . . . . 999.99000000000001 111.396 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 57.7 t30 55.89 42.95 28.27 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.58 0.55 . . . . 675.44000000000005 111.447 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mtp -99.74 84.2 2.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.211 -0.449 . . . . 999.99000000000001 111.22 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 77.2 mt -94.43 117.05 67.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.924 -0.58 . . . . 390.38 110.303 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -59.99 139.96 90.38 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.813 2.342 . . . . 243.11000000000001 112.718 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -84.61 144.88 28.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.242 -0.435 . . . . 618.10000000000002 110.66 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.805 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.1 t80 -68.55 108.78 3.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.833 0.349 . . . . 999.99000000000001 111.155 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.43 138.57 20.51 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.087 -0.506 . . . . 415.25 110.851 179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -57.03 -33.6 96.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.836 2.357 . . . . 529.14999999999998 112.042 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -61.06 -38.78 87.42 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.393 -0.821 . . . . 516.88 111.472 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 64.4 mtt -60.18 -41.78 93.6 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.785 0.326 . . . . 914.60000000000002 110.532 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 87.8 tt0 -61.88 -42.55 99.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 675.30999999999995 110.622 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.12 -41.08 99.27 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.275 -0.421 . . . . 900.95000000000005 110.935 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.94 -44.32 97.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.142 -0.481 . . . . 300.73000000000002 110.796 178.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -38.33 90.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.349 -0.387 . . . . 595.28999999999996 111.704 179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.44 -35.11 79.94 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.655 0.613 . . . . 999.99000000000001 112.655 -179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.5 ptp -90.51 149.38 22.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.035 0.445 . . . . 385.68000000000001 112.175 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.7 mmp_? -53.51 145.61 27.74 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 115.458 -0.792 . . . . 999.99000000000001 111.211 178.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -59.79 -26.21 81.57 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.948 2.432 . . . . 149.59999999999999 112.87 -179.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.625 ' HA ' HG21 ' A' ' 17' ' ' VAL . . . -62.35 -35.98 80.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.294 -0.412 . . . . 147.02000000000001 111.695 179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -90.73 -1.08 57.88 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.45 -0.341 . . . . 360.37 111.785 -179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 94.0 t -81.87 121.99 79.71 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.571 -0.286 . . . . 187.93000000000001 110.758 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -68.56 149.1 73.86 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.39 2.06 . . . . 265.38999999999999 112.534 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 63.4 t -124.71 137.95 55.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.9 -0.591 . . . . 246.78 110.052 -179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -122.35 136.71 54.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 999.99000000000001 110.875 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -84.12 171.3 12.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 495.41000000000003 110.45 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.185 -0.912 . . . . 761.34000000000003 111.115 -179.274 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 120.783 0.325 . . . . 999.99000000000001 110.445 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.8 m -124.25 139.1 54.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.819 0.342 . . . . 999.99000000000001 111.249 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -118.75 147.16 44.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.519 . . . . 999.99000000000001 110.157 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -85.56 -171.6 3.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.123 -0.489 . . . . 999.99000000000001 111.067 -179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -67.79 -24.68 65.34 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.119 -0.491 . . . . 999.99000000000001 111.156 -179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 65.5 t -99.93 126.6 53.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 375.51999999999998 109.904 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 pm0 -79.16 156.74 76.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.967 -0.56 . . . . 999.99000000000001 110.959 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -68.37 152.14 75.65 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.425 2.083 . . . . 436.63 112.573 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -109.59 151.24 27.06 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 999.99000000000001 110.399 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -82.14 73.5 9.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.875 0.369 . . . . 999.99000000000001 111.087 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mp -56.96 151.38 14.89 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.608 -0.724 . . . . 781.60000000000002 111.351 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -61.57 129.05 39.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.354 -0.385 . . . . 216.75 110.582 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.74 -39.94 93.33 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.07 -0.514 . . . . 902.89999999999998 111.655 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.03 87.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.013 0.435 . . . . 121.34999999999999 111.422 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -70.52 -34.72 72.62 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 265.05000000000001 110.222 179.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -67.01 -41.14 87.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.699 -0.682 . . . . 524.44000000000005 112.07 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.787 HG11 ' HA ' ' A' ' 127' ' ' ALA . 30.1 m -73.8 -28.99 25.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 N-CA-C 112.033 0.383 . . . . 214.56 112.033 -179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -44.73 93.29 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 121.222 0.534 . . . . 61.909999999999997 109.892 178.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.11 -36.06 72.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.279 -0.873 . . . . 321.58999999999997 111.081 178.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.48 ' O ' HG12 ' A' ' 24' ' ' ILE . 64.4 tttm -59.11 -41.93 89.34 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.641 -0.709 . . . . 491.97000000000003 111.712 -178.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.88 -44.6 99.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.584 0.23 . . . . 179.68000000000001 110.99 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -64.71 -43.26 94.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.944 0.402 . . . . 483.12 110.955 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.4 -43.92 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 115.795 -0.639 . . . . 120.91 111.59 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 20' ' ' LYS . 29.9 mm -61.06 -41.23 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 116.373 -0.376 . . . . 324.41000000000003 111.451 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.9 -43.03 95.05 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.524 0.194 . . . . 76.379999999999995 111.524 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -64.48 -41.37 98.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.831 -0.699 . . . . 59.560000000000002 112.548 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 38.7 m-85 -74.48 -20.1 60.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.633 0.254 . . . . 169.43000000000001 111.531 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -76.13 -37.27 58.23 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.969 -0.382 . . . . 145.09 109.969 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -63.3 -40.69 98.06 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.103 -0.703 . . . . 779.76999999999998 109.103 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.503 ' O ' ' HE3' ' A' ' 34' ' ' TRP . . . -61.81 -37.23 93.96 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 115.013 -0.994 . . . . 72.329999999999998 112.58 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 82.0 mt -58.76 -36.53 74.52 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 122.164 0.186 . . . . 213.66999999999999 111.171 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 70.3 t -59.32 -41.61 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 116.214 -0.448 . . . . 275.81999999999999 111.222 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.52 -42.57 99.01 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.525 0.202 . . . . 545.0 111.381 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.503 ' HE3' ' O ' ' A' ' 30' ' ' GLY . 8.0 m-90 -73.23 -31.89 64.41 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.531 0.205 . . . . 999.99000000000001 110.992 178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 31' ' ' LEU . 86.3 mt -62.78 -37.21 85.75 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.93 0.395 . . . . 205.93000000000001 110.863 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.2 mtp85 -62.94 -37.29 86.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.322 -0.399 . . . . 557.46000000000004 111.384 179.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.66 -51.99 12.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 113.424 0.898 . . . . 284.56999999999999 113.424 -178.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.438 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 98.1 m-70 -108.93 -21.26 12.73 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.967 0.728 . . . . 350.44 112.967 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.641 ' HA2' HD12 ' A' ' 42' ' ' LEU . . . -59.73 -37.9 93.08 Favored Glycine 0 N--CA 1.46 0.25 0 C-N-CA 121.233 -0.508 . . . . 199.69999999999999 113.325 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -61.71 -20.46 63.52 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.988 0.366 . . . . 999.99000000000001 111.988 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.3 p -105.63 -4.36 21.17 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 111.983 0.364 . . . . 302.80000000000001 111.983 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.641 HD12 ' HA2' ' A' ' 39' ' ' GLY . 91.0 mt -72.92 146.28 46.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.084 0.469 . . . . 581.97000000000003 111.63 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.0 m -76.82 164.55 25.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.808 -0.633 . . . . 239.06999999999999 110.582 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 88.6 m -59.67 -41.95 91.78 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.346 -0.388 . . . . 192.00999999999999 111.072 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 114' ' ' TYR . 69.5 t -65.87 -42.47 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.26 -0.427 . . . . 278.44999999999999 110.482 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -63.28 -40.59 97.81 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.125 -0.488 . . . . 316.42000000000002 111.16 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -61.38 -46.66 89.27 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.271 -0.422 . . . . 470.35000000000002 110.784 179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -65.58 -39.71 91.94 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.303 -0.408 . . . . 369.77999999999997 111.177 179.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.27 83.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.722 -0.672 . . . . 66.790000000000006 111.907 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.6 -32.08 49.64 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.77 0.656 . . . . 238.30000000000001 112.77 -179.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -62.93 -42.88 99.94 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.801 0.334 . . . . 526.92999999999995 110.751 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -70.99 -39.27 72.57 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.196 0.522 . . . . 162.88 109.813 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -60.5 -41.42 87.59 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 CA-C-N 115.252 -0.885 . . . . 139.00999999999999 111.191 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -58.68 -45.19 89.97 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.501 0.191 . . . . 198.61000000000001 110.921 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -65.07 -41.59 94.93 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 120.747 0.308 . . . . 999.99000000000001 110.747 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -63.9 -40.84 97.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.266 0.555 . . . . 799.64999999999998 110.253 178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -58.96 -48.51 81.27 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.282 -0.872 . . . . 151.58000000000001 110.376 179.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -45.7 92.03 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.729 -0.669 . . . . 168.43000000000001 111.49 179.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -62.54 -39.65 94.29 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.264 -0.425 . . . . 530.55999999999995 111.689 -179.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.5 m -61.09 -47.06 88.06 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.985 0.421 . . . . 293.49000000000001 110.776 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.49 ' O ' ' HD1' ' A' ' 65' ' ' TYR . 67.7 m80 -70.12 -38.71 75.65 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.088 -0.505 . . . . 383.72000000000003 111.346 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -60.29 -48.16 82.93 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.301 -0.409 . . . . 497.0 111.02 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.64 94.19 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 111.843 0.312 . . . . 177.0 111.843 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.85 -48.45 78.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.426 -0.352 . . . . 478.75999999999999 111.727 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.49 ' HD1' ' O ' ' A' ' 61' ' ' HIS . 62.7 m-85 -71.06 -36.38 72.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.524 -0.307 . . . . 727.09000000000003 111.79 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 62.4 ttp -52.42 -44.89 65.67 Favored 'General case' 0 N--CA 1.465 0.313 0 O-C-N 123.381 0.425 . . . . 664.46000000000004 112.062 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 85.8 mt -61.45 -42.23 98.43 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.479 0.18 . . . . 447.74000000000001 111.16 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -68.84 -40.39 79.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.892 0.377 . . . . 999.99000000000001 110.593 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 88' ' ' LEU . 95.1 mt -63.65 -44.84 98.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.761 -0.654 . . . . 398.94999999999999 110.883 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.69 -39.43 88.46 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.282 -0.417 . . . . 366.97000000000003 111.567 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.28 -48.19 82.8 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.857 0.361 . . . . 709.00999999999999 110.496 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.7 tptm -64.79 -45.11 87.68 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.858 -0.61 . . . . 931.13999999999999 111.092 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 69' ' ' ILE . 37.4 mm -62.96 -45.8 97.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.028 -0.533 . . . . 175.25999999999999 111.948 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -61.6 -40.46 94.9 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.745 -0.207 . . . . 443.19 110.997 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.42 -40.5 95.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.44 -0.345 . . . . 366.44 111.135 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.9 mt -70.06 -39.94 75.36 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.189 -0.46 . . . . 386.93000000000001 111.425 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.9 -8.82 79.26 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 121.107 -0.568 . . . . 244.66999999999999 112.411 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -74.73 152.07 39.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.622 0.249 . . . . 999.99000000000001 111.318 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.0 p -115.2 94.36 38.79 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.51 -0.314 . . . . 263.29000000000002 110.987 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.34 143.23 97.78 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.323 2.682 . . . . 173.88999999999999 113.446 -179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.429 ' O ' ' HD1' ' A' ' 85' ' ' TYR . 16.2 m -100.76 -177.82 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.842 -0.617 . . . . 201.66 110.607 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 72.1 t -58.13 -42.48 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-N 116.421 -0.354 . . . . 81.090000000000003 110.88 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.8 -39.47 96.83 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.894 -0.669 . . . . 106.63 112.28 179.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.21 -38.52 91.33 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 397.23000000000002 111.428 179.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 81' ' ' VAL . 39.3 m-85 -67.91 -26.4 65.97 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.749 0.648 . . . . 176.41 112.749 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 1.3 t -57.14 -34.66 68.62 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 121.004 -0.278 . . . . 224.31999999999999 111.218 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -65.53 -41.11 93.43 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.954 0.407 . . . . 999.99000000000001 110.484 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.464 HD13 HD13 ' A' ' 69' ' ' ILE . 86.8 mt -66.93 -40.96 87.75 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.796 -0.638 . . . . 158.16999999999999 110.493 179.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.74 -40.73 99.57 Favored Glycine 0 C--N 1.335 0.491 0 CA-C-N 115.626 -0.715 . . . . 65.709999999999994 112.178 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 94' ' ' ARG . . . -61.96 -39.77 93.3 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.636 0.255 . . . . 95.379999999999995 110.933 179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.05 -40.48 94.8 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.254 -0.43 . . . . 381.13999999999999 110.595 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.93 -42.57 96.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.897 -0.592 . . . . 182.12 110.348 179.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -65.05 -17.33 63.27 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.787 -0.642 . . . . 88.799999999999997 113.437 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 90' ' ' ALA . 99.5 mtt180 -80.09 -13.03 59.61 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.987 0.394 . . . . 999.99000000000001 111.178 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -107.48 112.1 24.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.914 0.387 . . . . 999.99000000000001 110.282 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 78.2 mt -125.4 125.95 69.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.292 -0.413 . . . . 308.67000000000002 110.746 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -130.6 48.53 2.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.077 0.465 . . . . 388.05000000000001 110.516 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.448 ' O ' ' HD1' ' A' ' 102' ' ' TYR . 67.2 mtt -66.77 -35.54 80.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.654 -0.703 . . . . 360.56999999999999 111.661 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -59.4 -38.12 79.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.32 -0.4 . . . . 184.22999999999999 111.33 -179.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -59.27 -47.13 86.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.272 -0.422 . . . . 999.99000000000001 110.397 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 93.0 t80 -58.62 -48.26 81.59 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.106 -0.497 . . . . 374.13 111.249 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HD1' ' O ' ' A' ' 98' ' ' MET . 58.1 m-85 -62.81 -41.63 99.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.768 0.318 . . . . 999.99000000000001 110.985 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -64.23 -43.6 94.45 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.076 -0.511 . . . . 558.87 111.224 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.77 -41.36 97.6 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.154 -0.475 . . . . 332.85000000000002 111.721 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.91 -48.48 76.43 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.465 -0.334 . . . . 472.20999999999998 111.08 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.94 -40.21 95.91 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.678 0.275 . . . . 821.44000000000005 111.283 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -58.62 -44.67 90.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.19 -0.459 . . . . 746.24000000000001 111.959 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -86.53 -11.26 52.13 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.897 0.332 . . . . 999.99000000000001 111.897 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 55.07 39.94 31.73 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.397 0.435 . . . . 675.44000000000005 111.778 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.1 mmm -109.68 108.8 19.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.871 0.367 . . . . 999.99000000000001 111.483 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 49.0 mm -94.46 120.02 65.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 390.38 110.126 179.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.61 146.14 54.12 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.279 1.986 . . . . 243.11000000000001 112.754 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -84.94 142.26 29.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.155 -0.475 . . . . 618.10000000000002 110.692 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.51 ' HB2' HG13 ' A' ' 45' ' ' VAL . 78.2 t80 -69.34 109.6 4.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.401 -0.363 . . . . 999.99000000000001 110.969 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.2 mp -98.59 126.02 40.64 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.437 -0.347 . . . . 415.25 111.011 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -56.91 -32.63 93.05 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.042 2.495 . . . . 529.14999999999998 112.355 178.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -59.74 -45.28 92.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.758 -0.655 . . . . 516.88 111.642 179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 77.9 mtm -60.16 -40.89 91.48 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.695 0.283 . . . . 914.60000000000002 110.253 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 55.2 tp10 -60.79 -43.0 98.68 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.976 -0.557 . . . . 675.30999999999995 110.104 178.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.505 ' O ' ' HG2' ' A' ' 124' ' ' MET . 88.9 tt0 -61.62 -44.74 96.43 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.813 -0.63 . . . . 900.95000000000005 110.973 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 34.8 mm -61.53 -43.74 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.236 0 CA-C-N 116.419 -0.355 . . . . 300.73000000000002 111.392 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -61.8 -38.66 88.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.624 0.25 . . . . 595.28999999999996 111.474 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -66.44 -32.66 74.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.338 -0.392 . . . . 999.99000000000001 111.771 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 120' ' ' GLU . 26.5 mmt -70.43 141.31 52.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.503 -0.317 . . . . 385.68000000000001 111.416 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.499 ' O ' HG23 ' A' ' 129' ' ' VAL . 95.7 mtm-85 -52.26 139.46 35.98 Favored Pre-proline 0 N--CA 1.465 0.297 0 CA-C-N 115.776 -0.647 . . . . 999.99000000000001 111.044 178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -60.44 -25.97 81.7 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 122.734 2.289 . . . . 149.59999999999999 112.794 -179.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.787 ' HA ' HG11 ' A' ' 17' ' ' VAL . . . -62.22 -36.7 82.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.226 -0.443 . . . . 147.02000000000001 111.43 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -92.12 -0.09 57.45 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.191 0.441 . . . . 360.37 112.191 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 125' ' ' ARG . 63.0 t -89.59 117.55 68.25 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.692 0.282 . . . . 187.93000000000001 111.305 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -72.83 160.85 45.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.814 2.343 . . . . 265.38999999999999 112.388 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 92.3 t -106.18 137.19 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.936 0.398 . . . . 246.78 110.444 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -96.4 126.94 41.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 999.99000000000001 110.891 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -82.76 149.66 27.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.095 -0.502 . . . . 495.41000000000003 110.15 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 39.3 mmt . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.471 -0.776 . . . . 761.34000000000003 110.767 -179.718 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.9 mtt85 . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 113.715 1.006 . . . . 999.99000000000001 113.715 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.1 m -130.66 141.8 50.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.768 -0.196 . . . . 999.99000000000001 110.827 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 9.0 t-105 -157.51 142.29 16.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.47 -0.332 . . . . 999.99000000000001 110.393 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -65.05 -39.26 93.03 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.697 0.628 . . . . 999.99000000000001 112.697 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -87.05 -90.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.159 0.429 . . . . 999.99000000000001 112.159 -178.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.0 122.84 70.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.766 0.317 . . . . 375.51999999999998 111.037 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -88.29 126.49 60.36 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.967 -0.561 . . . . 999.99000000000001 110.704 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.656 ' HB3' HD12 ' A' ' 11' ' ' LEU . 59.9 Cg_exo -56.55 134.66 65.79 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.712 2.275 . . . . 436.63 112.2 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -125.59 -47.07 1.71 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.465 -0.334 . . . . 999.99000000000001 111.838 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -105.28 -7.79 18.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.327 0.491 . . . . 999.99000000000001 112.327 -178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.656 HD12 ' HB3' ' A' ' 8' ' ' PRO . 92.0 mt -58.81 138.99 56.93 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.886 0.374 . . . . 781.60000000000002 111.573 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 57.3 t-20 -100.3 118.51 36.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.237 -0.438 . . . . 216.75 110.179 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -61.6 -38.94 89.43 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.003 -0.544 . . . . 902.89999999999998 111.643 -179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.03 87.29 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.856 0.36 . . . . 121.34999999999999 111.396 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -70.07 -30.72 68.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 265.05000000000001 110.03 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -64.38 -39.05 93.11 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 115.746 -0.661 . . . . 524.44000000000005 109.526 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.31 -44.88 96.76 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.51 -0.768 . . . . 214.56 111.017 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 21' ' ' VAL . . . -61.89 -38.77 89.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.151 0.501 . . . . 61.909999999999997 110.397 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.6 tp -64.6 -39.61 94.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.759 -0.655 . . . . 321.58999999999997 111.085 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 24' ' ' ILE . 98.1 mttt -60.23 -41.24 92.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.81 0.671 . . . . 491.97000000000003 112.81 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.539 HG12 ' O ' ' A' ' 18' ' ' ALA . 9.9 p -66.03 -36.36 77.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 120.719 -0.393 . . . . 179.68000000000001 111.208 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.432 ' OE1' ' HA ' ' A' ' 86' ' ' THR . 63.1 tt0 -67.02 -39.98 87.15 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.101 0.477 . . . . 483.12 110.249 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.89 -43.52 98.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 115.544 -0.753 . . . . 120.91 110.436 179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 20' ' ' LYS . 31.8 mm -60.09 -43.91 93.86 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-N 115.511 -0.768 . . . . 324.41000000000003 111.775 -179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -44.96 95.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.013 0.375 . . . . 76.379999999999995 112.013 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.3 -42.83 95.95 Favored Glycine 0 CA--C 1.52 0.374 0 C-N-CA 120.731 -0.747 . . . . 59.560000000000002 113.103 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.437 ' HE1' HG22 ' A' ' 92' ' ' ILE . 38.0 m-85 -74.69 -19.81 60.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.056 0.391 . . . . 169.43000000000001 112.056 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.427 ' O ' HG23 ' A' ' 32' ' ' VAL . 28.7 t0 -76.42 -39.48 53.42 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.738 -0.21 . . . . 145.09 111.182 -178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -62.55 -43.33 99.08 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.947 0.403 . . . . 779.76999999999998 109.944 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.31 -39.58 94.37 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.691 -0.686 . . . . 72.329999999999998 112.225 178.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.1 tp -63.24 -42.56 99.24 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 122.33 0.252 . . . . 213.66999999999999 111.209 -179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 28' ' ' ASP . 63.0 t -60.94 -46.03 97.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.567 -0.288 . . . . 275.81999999999999 110.929 -179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -63.17 -41.25 99.2 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.848 0.356 . . . . 545.0 110.636 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 85.0 t90 -63.92 -44.13 93.83 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.337 0.589 . . . . 999.99000000000001 109.978 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.461 HD21 ' HE3' ' A' ' 47' ' ' LYS . 61.7 tp -60.77 -39.07 87.43 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 115.104 -0.953 . . . . 205.93000000000001 111.42 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -64.4 -25.01 67.83 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 111.907 0.336 . . . . 557.46000000000004 111.907 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.3 t -86.81 -51.06 13.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 N-CA-C 113.128 0.788 . . . . 284.56999999999999 113.128 -178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.653 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 99.1 m-70 -98.98 -4.03 33.56 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 112.737 0.643 . . . . 350.44 112.737 -178.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.49 -34.9 70.16 Favored Glycine 0 N--CA 1.46 0.289 0 CA-C-N 116.169 -0.468 . . . . 199.69999999999999 114.086 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HG3' HG23 ' A' ' 41' ' ' THR . 41.1 ptt180 -62.26 -19.91 63.71 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.098 0.407 . . . . 999.99000000000001 112.098 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.492 HG23 ' HG3' ' A' ' 40' ' ' ARG . 70.2 p -111.69 -13.06 13.8 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.792 0.664 . . . . 302.80000000000001 112.792 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 38' ' ' HIS . 95.1 mt -72.96 137.27 45.39 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.804 0.335 . . . . 581.97000000000003 111.815 -179.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.5 p -78.04 165.47 23.98 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.305 -0.407 . . . . 239.06999999999999 110.359 178.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 89.8 m -61.76 -44.15 97.45 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.771 0.319 . . . . 192.00999999999999 111.188 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.627 HG13 ' HB2' ' A' ' 114' ' ' TYR . 70.6 t -66.91 -43.69 89.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 116.219 -0.446 . . . . 278.44999999999999 111.035 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.471 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 64.9 tt0 -63.11 -40.78 98.62 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.202 -0.453 . . . . 316.42000000000002 111.12 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HE3' HD21 ' A' ' 35' ' ' LEU . 87.8 tttt -60.36 -47.12 87.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.311 -0.404 . . . . 470.35000000000002 111.241 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.88 -40.38 95.02 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.906 0.384 . . . . 369.77999999999997 110.914 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.68 86.13 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.711 -0.677 . . . . 66.790000000000006 111.647 179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 46' ' ' GLN . 83.9 mt -60.61 -35.63 76.61 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.899 0.703 . . . . 238.30000000000001 112.899 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -59.67 -41.24 90.16 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 109.969 -0.382 . . . . 526.92999999999995 109.969 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -68.69 -39.41 80.53 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.217 -0.447 . . . . 162.88 109.898 177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.446 HG11 ' CE2' ' A' ' 101' ' ' PHE . 57.4 t -60.32 -41.29 86.64 Favored 'Isoleucine or valine' 0 C--N 1.338 0.097 0 CA-C-N 115.877 -0.601 . . . . 139.00999999999999 110.442 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -59.11 -42.43 90.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.427 -0.351 . . . . 198.61000000000001 110.394 179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.655 ' O ' ' HG2' ' A' ' 58' ' ' MET . 98.7 mtt180 -64.77 -42.54 95.04 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.18 -0.464 . . . . 999.99000000000001 110.439 178.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -65.31 -42.71 92.72 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.496 0.665 . . . . 799.64999999999998 110.633 178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -60.59 -47.02 88.05 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.96 -1.018 . . . . 151.58000000000001 111.865 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.655 ' HG2' ' O ' ' A' ' 55' ' ' ARG . 14.0 ptt? -58.98 -39.27 81.26 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.745 0.307 . . . . 168.43000000000001 110.852 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.453 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 98.3 mm-40 -69.63 -39.05 77.39 Favored 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 116.189 -0.46 . . . . 530.55999999999995 111.2 179.055 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.7 m -61.44 -48.01 83.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.288 -0.414 . . . . 293.49000000000001 110.959 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.6 -48.53 79.0 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.083 -0.508 . . . . 383.72000000000003 110.827 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.4 t-105 -64.85 -40.24 94.84 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.912 0.708 . . . . 497.0 112.912 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.93 -37.9 72.13 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.915 0.709 . . . . 177.0 112.915 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.68 -46.97 87.46 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.674 0.273 . . . . 478.75999999999999 110.977 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -77.83 -41.1 38.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.418 -0.355 . . . . 727.09000000000003 111.127 179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 27.6 ttt -53.6 -45.02 69.88 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 113.013 0.745 . . . . 664.46000000000004 113.013 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.2 tp -57.81 -45.46 86.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.014 0.375 . . . . 447.74000000000001 112.014 -178.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -65.56 -40.87 93.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 999.99000000000001 111.172 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 49.1 mm -70.63 -42.97 77.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.115 -0.493 . . . . 398.94999999999999 111.082 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -60.66 -38.9 86.41 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.805 -0.634 . . . . 366.97000000000003 111.925 -179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.22 -46.33 88.76 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 110.261 -0.274 . . . . 709.00999999999999 110.261 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -65.79 -41.28 92.18 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.357 -0.383 . . . . 931.13999999999999 111.071 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 93.9 mt -63.05 -45.69 98.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 116.381 -0.372 . . . . 175.25999999999999 110.998 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.85 -43.1 99.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.175 -0.466 . . . . 443.19 111.124 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.51 -40.26 96.58 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.348 -0.387 . . . . 366.44 111.09 179.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.4 mt -68.58 -38.54 80.78 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.169 -0.469 . . . . 386.93000000000001 111.343 178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 88.7 5.02 75.16 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.952 -0.642 . . . . 244.66999999999999 112.48 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.6 mtp85 -74.18 147.56 42.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.867 0.365 . . . . 999.99000000000001 111.269 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 17.4 p -102.9 109.39 61.23 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 263.29000000000002 110.812 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -59.43 138.44 84.17 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.746 2.297 . . . . 173.88999999999999 112.549 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.9 m -102.37 172.61 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.447 . . . . 201.66 111.692 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 67.3 t -61.16 -41.13 88.28 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 115.68 -0.691 . . . . 81.090000000000003 110.97 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.539 ' O ' HG22 ' A' ' 86' ' ' THR . . . -60.02 -41.88 98.14 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.782 -0.723 . . . . 106.63 112.398 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -64.84 -40.13 94.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.128 0.489 . . . . 397.23000000000002 110.216 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -66.63 -39.88 88.48 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.517 -0.765 . . . . 176.41 111.591 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 83' ' ' GLY . 0.9 OUTLIER -64.22 -34.33 77.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.988 -0.285 . . . . 224.31999999999999 111.025 -179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -65.73 -40.99 92.74 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 121.212 0.529 . . . . 999.99000000000001 109.593 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.98 -38.61 86.38 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.327 -0.851 . . . . 158.16999999999999 110.476 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.99 -39.18 95.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.621 -0.718 . . . . 65.709999999999994 113.067 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.07 -41.7 97.12 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.895 0.379 . . . . 95.379999999999995 110.2 179.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.4 -40.39 89.58 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.839 -0.619 . . . . 381.13999999999999 110.363 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.437 HG22 ' HE1' ' A' ' 27' ' ' PHE . 97.3 mt -61.61 -45.6 98.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.729 -0.669 . . . . 182.12 111.321 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -81.9 -2.56 90.59 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.937 -0.649 . . . . 88.799999999999997 113.64 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -79.45 -30.67 42.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.123 0.461 . . . . 999.99000000000001 110.953 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -108.63 112.65 25.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.512 -0.313 . . . . 999.99000000000001 110.937 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.7 mm -124.89 125.55 69.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.585 -0.524 . . . . 308.67000000000002 109.585 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -141.76 68.97 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.894 0.378 . . . . 388.05000000000001 111.582 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 97.3 mmm -70.97 -28.21 64.29 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.86 -0.609 . . . . 360.56999999999999 111.192 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.21 -38.16 82.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.66 -0.7 . . . . 184.22999999999999 112.031 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 92.3 t80 -59.24 -48.8 80.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.4 -0.363 . . . . 999.99000000000001 111.135 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.446 ' CE2' HG11 ' A' ' 53' ' ' VAL . 83.3 t80 -60.01 -46.81 88.26 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 116.585 -0.279 . . . . 374.13 110.962 179.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -58.44 -47.44 83.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.037 -0.529 . . . . 999.99000000000001 111.141 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -60.7 -46.08 91.75 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.578 -0.283 . . . . 558.87 110.804 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.16 98.08 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.256 -0.429 . . . . 332.85000000000002 111.378 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 62.4 tp -62.49 -45.23 93.96 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.981 -0.554 . . . . 472.20999999999998 110.956 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -62.75 -39.31 93.71 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.243 -0.435 . . . . 821.44000000000005 110.782 179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -58.13 -40.95 82.61 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.962 -0.563 . . . . 746.24000000000001 111.39 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -83.41 -11.73 57.25 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.316 -0.402 . . . . 999.99000000000001 111.518 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.5 t30 54.06 45.99 26.39 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 122.96 0.504 . . . . 675.44000000000005 111.781 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 99.4 mtp -107.91 113.85 27.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.881 0.372 . . . . 999.99000000000001 111.361 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 74.8 mt -94.33 118.73 67.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 390.38 110.185 179.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.66 139.51 34.11 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.307 2.005 . . . . 243.11000000000001 112.97 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -86.07 141.27 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 618.10000000000002 110.692 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.627 ' HB2' HG13 ' A' ' 45' ' ' VAL . 65.8 t80 -68.66 119.93 13.86 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.714 0.292 . . . . 999.99000000000001 110.615 179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -98.59 123.83 48.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.47 -0.332 . . . . 415.25 111.322 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -57.83 -31.74 93.19 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.953 2.435 . . . . 529.14999999999998 112.449 178.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -61.24 -28.17 68.97 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.696 -0.684 . . . . 516.88 111.702 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 39.0 mmt -60.06 -37.66 80.53 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.337 -0.392 . . . . 914.60000000000002 111.093 -179.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.58 -40.32 91.28 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.192 -0.458 . . . . 675.30999999999995 110.933 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.27 -40.55 96.22 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.475 -0.329 . . . . 900.95000000000005 110.978 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 31.2 mm -61.43 -45.72 98.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.152 -0.477 . . . . 300.73000000000002 110.673 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -63.05 -39.1 93.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.817 -0.628 . . . . 595.28999999999996 111.995 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 54.8 mmm-85 -67.72 -34.25 76.49 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.973 0.731 . . . . 999.99000000000001 112.973 -179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 25.2 ptp -81.3 151.02 28.25 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.129 0.49 . . . . 385.68000000000001 112.252 -178.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -51.75 134.52 36.54 Favored Pre-proline 0 N--CA 1.466 0.353 0 CA-C-N 115.285 -0.87 . . . . 999.99000000000001 111.457 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -53.12 -32.59 59.94 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.303 2.668 . . . . 149.59999999999999 113.171 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.07 -36.25 76.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 147.02000000000001 111.663 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -91.87 8.14 38.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.453 -0.34 . . . . 360.37 111.736 -179.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 72.8 t -91.43 114.78 62.87 Favored Pre-proline 0 C--O 1.234 0.244 0 CA-C-O 120.818 0.342 . . . . 187.93000000000001 110.965 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.46 157.59 49.02 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.676 2.251 . . . . 265.38999999999999 112.772 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.453 ' HB ' ' HG3' ' A' ' 59' ' ' GLN . 16.7 m -126.84 158.82 37.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.074 -0.512 . . . . 246.78 110.593 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -113.98 128.94 56.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.881 0.372 . . . . 999.99000000000001 111.297 -179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -83.17 161.62 21.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.928 -0.578 . . . . 495.41000000000003 109.985 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.7 tpt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.173 -0.918 . . . . 761.34000000000003 110.687 -179.411 . . . . . . . . 0 0 . 1 stop_ save_